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Chemical ID: 5180397
Chemical ID:
5180397
Name [?]:
N-methyl-1-phenyl-cyclopropan-1-amine
SMILES [?]:
CNC1(CC1)c2ccccc2
InChi [?]:
InChI=1/C10H13N/c1-11-10(7-8-10)9-5-3-2-4-6-9/h2-6,11H,7-8H2,1H3
InChi Info:
AuxInfo=1/0/N:1,9,8,10,7,11,4,5,6,3,2/E:(3,4)(5,6)(7,8)/rA:11nCNCCCCCCCCC/rB:s1;s2;s3;s3s4;s3;s6;d7;s8;d9;d6s10;/rC:;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C10H13N |
All Atoms: | 11 |
Heavy Atoms: | 11 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 6.91319 |
Area: | 312.408 |
Solvation: | -0.897014 |
Coulombic: | -10.8501 |
Bond Count [?]
All: | 12 |
Single: | 9 |
Double: | 3 |
Rotors: | 2 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 147.217 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 1 |
XLogP: | 1.83 |
LogP (Chemaxon): | 1.7 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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