6-chloro-N-(cyclohexylmethyl)-N-methylpyridin-2-amine

C13H19ClN2 — CID 63587269

IUPAC6-chloro-N-(cyclohexylmethyl)-N-methylpyridin-2-amine
SMILESCN(CC1CCCCC1)c1cccc(Cl)n1
InChIInChI=1S/C13H19ClN2/c1-16(10-11-6-3-2-4-7-11)13-9-5-8-12(14)15-13/h5,8-9,11H,2-4,6-7,10H2,1H3
InChIKeySPTUHLYECLSDCA-UHFFFAOYSA-N
MW238.76 g/mol
LogP3.75
Rot. Bonds3

About 6-chloro-N-(cyclohexylmethyl)-N-methylpyridin-2-amine

6-chloro-N-(cyclohexylmethyl)-N-methylpyridin-2-amine (PubChem CID 63587269) has the molecular formula C13H19ClN2 and a molecular weight of 238.76 g/mol. Its IUPAC name is 6-chloro-N-(cyclohexylmethyl)-N-methylpyridin-2-amine.

Molecular Properties

Compound Name6-chloro-N-(cyclohexylmethyl)-N-methylpyridin-2-amine
PubChem CID63587269
Molecular FormulaC13H19ClN2
Molecular Weight238.76 g/mol
Exact Mass238.12
IUPAC Name6-chloro-N-(cyclohexylmethyl)-N-methylpyridin-2-amine
SMILESCN(CC1CCCCC1)c1cccc(Cl)n1
InChIInChI=1S/C13H19ClN2/c1-16(10-11-6-3-2-4-7-11)13-9-5-8-12(14)15-13/h5,8-9,11H,2-4,6-7,10H2,1H3
InChIKeySPTUHLYECLSDCA-UHFFFAOYSA-N
XLogP3.75
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.76
LogP ≤ 53.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

6-N-(cyclopentylmethyl)-6-N-methylpyridine-2,6-diamine
CID 80653540
6-chloro-N-(cyclopentylmethyl)-N-methylpyridazin-3-amine
CID 63655754
[3-chloro-6-[cyclohexylmethyl(methyl)amino]-2-pyridinyl]methanol
CID 54949040
2-chloro-6-[cyclohexylmethyl(methyl)amino]pyridine-4-carboxylic acid
CID 61446979
6-chloro-N-(cyclopropylmethyl)-N-propylpyridin-2-amine
CID 63587069
[3-chloro-6-[cyclobutylmethyl(methyl)amino]-2-pyridinyl]methanol
CID 62861534
N-(cyclopropylmethyl)-N-methyl-6-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 62284019
N-(cyclopentylmethyl)-2-cyclopropyl-N-methylpyrimidin-4-amine
CID 133304236
[6-[cyclohexylmethyl(methyl)amino]pyridazin-3-yl]methanol
CID 54949130
5-(chloromethyl)-N-(cyclobutylmethyl)-N-methylpyrazin-2-amine
CID 107373461
6-chloro-N-(cyclobutylmethyl)-N-methylpyrimidin-4-amine
CID 62856781
2-chloro-N-(cyclobutylmethyl)-N-methyl-1,3-thiazol-4-amine
CID 130652422

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(cyclohexylmethyl)-N-methylpyridin-2-amine?
The IUPAC name of 6-chloro-N-(cyclohexylmethyl)-N-methylpyridin-2-amine (CID 63587269) is 6-chloro-N-(cyclohexylmethyl)-N-methylpyridin-2-amine.
What is the SMILES notation for 6-chloro-N-(cyclohexylmethyl)-N-methylpyridin-2-amine?
The canonical SMILES for 6-chloro-N-(cyclohexylmethyl)-N-methylpyridin-2-amine is CN(CC1CCCCC1)c1cccc(Cl)n1.
What is the InChIKey of 6-chloro-N-(cyclohexylmethyl)-N-methylpyridin-2-amine?
The InChIKey is SPTUHLYECLSDCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19ClN2/c1-16(10-11-6-3-2-4-7-11)13-9-5-8-12(14)15-13/h5,8-9,11H,2-4,6-7,10H2,1H3.
What are the key properties of 6-chloro-N-(cyclohexylmethyl)-N-methylpyridin-2-amine?
6-chloro-N-(cyclohexylmethyl)-N-methylpyridin-2-amine has a molecular weight of 238.76 g/mol, XLogP of 3.75, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(cyclohexylmethyl)-N-methylpyridin-2-amine is sourced from PubChem (CID 63587269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).