2-(aminomethyl)-N-[(1R)-1-pyridin-2-ylethyl]cyclohexan-1-amine

C14H23N3 — CID 81402190

IUPAC2-(aminomethyl)-N-[(1R)-1-pyridin-2-ylethyl]cyclohexan-1-amine
SMILESC[C@@H](NC1CCCCC1CN)c1ccccn1
InChIInChI=1S/C14H23N3/c1-11(13-7-4-5-9-16-13)17-14-8-3-2-6-12(14)10-15/h4-5,7,9,11-12,14,17H,2-3,6,8,10,15H2,1H3/t11-,12?,14?/m1/s1
InChIKeyDQTGHNJQYARDHW-LKSINWNRSA-N
MW233.36 g/mol
LogP2.25
Rot. Bonds4

About 2-(aminomethyl)-N-[(1R)-1-pyridin-2-ylethyl]cyclohexan-1-amine

2-(aminomethyl)-N-[(1R)-1-pyridin-2-ylethyl]cyclohexan-1-amine (PubChem CID 81402190) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is 2-(aminomethyl)-N-[(1R)-1-pyridin-2-ylethyl]cyclohexan-1-amine.

Molecular Properties

Compound Name2-(aminomethyl)-N-[(1R)-1-pyridin-2-ylethyl]cyclohexan-1-amine
PubChem CID81402190
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC Name2-(aminomethyl)-N-[(1R)-1-pyridin-2-ylethyl]cyclohexan-1-amine
SMILESC[C@@H](NC1CCCCC1CN)c1ccccn1
InChIInChI=1S/C14H23N3/c1-11(13-7-4-5-9-16-13)17-14-8-3-2-6-12(14)10-15/h4-5,7,9,11-12,14,17H,2-3,6,8,10,15H2,1H3/t11-,12?,14?/m1/s1
InChIKeyDQTGHNJQYARDHW-LKSINWNRSA-N
XLogP2.25
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

trans-(1S,2S)-2-[[(1R)-1-pyridin-2-ylethyl]amino]cyclohexan-1-ol
CID 102731505
N-[(1S)-1-pyridin-2-ylethyl]cyclododecanamine
CID 29052683
N-[(1S)-1-pyridin-2-ylethyl]cycloheptanamine
CID 28647798
N-(1-pyridin-2-ylethyl)cyclooctanamine
CID 43178142
2-(aminomethyl)-N-[(1S)-1-(4-bromophenyl)ethyl]cyclohexan-1-amine
CID 81354238
3-ethyl-2-methyl-N-(1-pyridin-2-ylethyl)cyclopentan-1-amine
CID 64921322
2-(1-pyridin-2-ylethylamino)cyclopentane-1-carbonitrile
CID 62741303
2-(aminomethyl)-N-[(1R)-1-(furan-2-yl)ethyl]cyclohexan-1-amine
CID 81403207
2,3-dimethyl-N-(1-pyridin-2-ylethyl)cyclopentan-1-amine
CID 64908416
N-(cyclopentylmethyl)-1-pyridin-2-ylethanamine
CID 21279046
N-[(1R)-1-pyridin-2-ylethyl]-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine
CID 81401806
2-(aminomethyl)-N-[(1S)-1-(furan-2-yl)ethyl]cyclopentan-1-amine
CID 81403374

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-[(1R)-1-pyridin-2-ylethyl]cyclohexan-1-amine?
The IUPAC name of 2-(aminomethyl)-N-[(1R)-1-pyridin-2-ylethyl]cyclohexan-1-amine (CID 81402190) is 2-(aminomethyl)-N-[(1R)-1-pyridin-2-ylethyl]cyclohexan-1-amine.
What is the SMILES notation for 2-(aminomethyl)-N-[(1R)-1-pyridin-2-ylethyl]cyclohexan-1-amine?
The canonical SMILES for 2-(aminomethyl)-N-[(1R)-1-pyridin-2-ylethyl]cyclohexan-1-amine is C[C@@H](NC1CCCCC1CN)c1ccccn1.
What is the InChIKey of 2-(aminomethyl)-N-[(1R)-1-pyridin-2-ylethyl]cyclohexan-1-amine?
The InChIKey is DQTGHNJQYARDHW-LKSINWNRSA-N. The full InChI is InChI=1S/C14H23N3/c1-11(13-7-4-5-9-16-13)17-14-8-3-2-6-12(14)10-15/h4-5,7,9,11-12,14,17H,2-3,6,8,10,15H2,1H3/t11-,12?,14?/m1/s1.
What are the key properties of 2-(aminomethyl)-N-[(1R)-1-pyridin-2-ylethyl]cyclohexan-1-amine?
2-(aminomethyl)-N-[(1R)-1-pyridin-2-ylethyl]cyclohexan-1-amine has a molecular weight of 233.36 g/mol, XLogP of 2.25, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-[(1R)-1-pyridin-2-ylethyl]cyclohexan-1-amine is sourced from PubChem (CID 81402190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).