[2-(cyclohexylmethyl)-1H-pyridin-2-yl]methanamine

C13H22N2 — CID 67633596

IUPAC[2-(cyclohexylmethyl)-1H-pyridin-2-yl]methanamine
SMILESNCC1(CC2CCCCC2)C=CC=CN1
InChIInChI=1S/C13H22N2/c14-11-13(8-4-5-9-15-13)10-12-6-2-1-3-7-12/h4-5,8-9,12,15H,1-3,6-7,10-11,14H2
InChIKeyDENVQAKGMCYTSC-UHFFFAOYSA-N
MW206.33 g/mol
LogP2.33
Rot. Bonds3

About [2-(cyclohexylmethyl)-1H-pyridin-2-yl]methanamine

[2-(cyclohexylmethyl)-1H-pyridin-2-yl]methanamine (PubChem CID 67633596) has the molecular formula C13H22N2 and a molecular weight of 206.33 g/mol. Its IUPAC name is [2-(cyclohexylmethyl)-1H-pyridin-2-yl]methanamine.

Molecular Properties

Compound Name[2-(cyclohexylmethyl)-1H-pyridin-2-yl]methanamine
PubChem CID67633596
Molecular FormulaC13H22N2
Molecular Weight206.33 g/mol
Exact Mass206.18
IUPAC Name[2-(cyclohexylmethyl)-1H-pyridin-2-yl]methanamine
SMILESNCC1(CC2CCCCC2)C=CC=CN1
InChIInChI=1S/C13H22N2/c14-11-13(8-4-5-9-15-13)10-12-6-2-1-3-7-12/h4-5,8-9,12,15H,1-3,6-7,10-11,14H2
InChIKeyDENVQAKGMCYTSC-UHFFFAOYSA-N
XLogP2.33
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.33
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [2-(cyclohexylmethyl)-1H-pyridin-2-yl]methanamine?
The IUPAC name of [2-(cyclohexylmethyl)-1H-pyridin-2-yl]methanamine (CID 67633596) is [2-(cyclohexylmethyl)-1H-pyridin-2-yl]methanamine.
What is the SMILES notation for [2-(cyclohexylmethyl)-1H-pyridin-2-yl]methanamine?
The canonical SMILES for [2-(cyclohexylmethyl)-1H-pyridin-2-yl]methanamine is NCC1(CC2CCCCC2)C=CC=CN1.
What is the InChIKey of [2-(cyclohexylmethyl)-1H-pyridin-2-yl]methanamine?
The InChIKey is DENVQAKGMCYTSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2/c14-11-13(8-4-5-9-15-13)10-12-6-2-1-3-7-12/h4-5,8-9,12,15H,1-3,6-7,10-11,14H2.
What are the key properties of [2-(cyclohexylmethyl)-1H-pyridin-2-yl]methanamine?
[2-(cyclohexylmethyl)-1H-pyridin-2-yl]methanamine has a molecular weight of 206.33 g/mol, XLogP of 2.33, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(cyclohexylmethyl)-1H-pyridin-2-yl]methanamine is sourced from PubChem (CID 67633596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).