N-(2,3-dimethylcyclohexyl)-1-pyridin-2-ylpiperidin-4-amine

C18H29N3 — CID 43765340

IUPACN-(2,3-dimethylcyclohexyl)-1-pyridin-2-ylpiperidin-4-amine
SMILESCC1CCCC(NC2CCN(c3ccccn3)CC2)C1C
InChIInChI=1S/C18H29N3/c1-14-6-5-7-17(15(14)2)20-16-9-12-21(13-10-16)18-8-3-4-11-19-18/h3-4,8,11,14-17,20H,5-7,9-10,12-13H2,1-2H3
InChIKeyONFXZTXXOUVNQE-UHFFFAOYSA-N
MW287.45 g/mol
LogP3.46
Rot. Bonds3

About N-(2,3-dimethylcyclohexyl)-1-pyridin-2-ylpiperidin-4-amine

N-(2,3-dimethylcyclohexyl)-1-pyridin-2-ylpiperidin-4-amine (PubChem CID 43765340) has the molecular formula C18H29N3 and a molecular weight of 287.45 g/mol. Its IUPAC name is N-(2,3-dimethylcyclohexyl)-1-pyridin-2-ylpiperidin-4-amine.

Molecular Properties

Compound NameN-(2,3-dimethylcyclohexyl)-1-pyridin-2-ylpiperidin-4-amine
PubChem CID43765340
Molecular FormulaC18H29N3
Molecular Weight287.45 g/mol
Exact Mass287.24
IUPAC NameN-(2,3-dimethylcyclohexyl)-1-pyridin-2-ylpiperidin-4-amine
SMILESCC1CCCC(NC2CCN(c3ccccn3)CC2)C1C
InChIInChI=1S/C18H29N3/c1-14-6-5-7-17(15(14)2)20-16-9-12-21(13-10-16)18-8-3-4-11-19-18/h3-4,8,11,14-17,20H,5-7,9-10,12-13H2,1-2H3
InChIKeyONFXZTXXOUVNQE-UHFFFAOYSA-N
XLogP3.46
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.45
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methylcyclopentyl)-3-(1-pyridin-2-ylpiperidin-4-yl)urea
CID 56826840
N-(2-propylcyclopropyl)-1-pyridin-2-ylpiperidin-4-amine
CID 103902772
N-(4-ethylcyclohexyl)-1-pyridin-2-ylpiperidin-4-amine
CID 43675378
N-(oxepan-4-yl)-1-pyridin-2-ylpiperidin-4-amine
CID 65082180
(3R)-N-methyl-1-pyridin-2-ylpyrrolidin-3-amine
CID 141191344
N-methyl-1-pyridin-2-ylpyrrolidin-3-amine
CID 79002061
N-(2-morpholin-3-ylcyclopentyl)-1-pyridin-2-ylpiperidin-4-amine;hydrochloride
CID 120915468
N-[(1R,2S)-2-methylcyclohexyl]-4-pyridin-2-ylpiperazine-1-carboxamide
CID 51642051
2-chloro-N-(1-pyridin-2-ylpiperidin-4-yl)pyridin-3-amine
CID 43782400
1-cyclopropyl-N-(2,3-dimethylcyclohexyl)piperidin-4-amine
CID 64761871
ethane;2-(4-pyrrolidin-1-ylpiperidin-1-yl)pyridine
CID 143719277
2-(4-bromo-3-methylpiperidin-1-yl)pyridine
CID 114682742

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylcyclohexyl)-1-pyridin-2-ylpiperidin-4-amine?
The IUPAC name of N-(2,3-dimethylcyclohexyl)-1-pyridin-2-ylpiperidin-4-amine (CID 43765340) is N-(2,3-dimethylcyclohexyl)-1-pyridin-2-ylpiperidin-4-amine.
What is the SMILES notation for N-(2,3-dimethylcyclohexyl)-1-pyridin-2-ylpiperidin-4-amine?
The canonical SMILES for N-(2,3-dimethylcyclohexyl)-1-pyridin-2-ylpiperidin-4-amine is CC1CCCC(NC2CCN(c3ccccn3)CC2)C1C.
What is the InChIKey of N-(2,3-dimethylcyclohexyl)-1-pyridin-2-ylpiperidin-4-amine?
The InChIKey is ONFXZTXXOUVNQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N3/c1-14-6-5-7-17(15(14)2)20-16-9-12-21(13-10-16)18-8-3-4-11-19-18/h3-4,8,11,14-17,20H,5-7,9-10,12-13H2,1-2H3.
What are the key properties of N-(2,3-dimethylcyclohexyl)-1-pyridin-2-ylpiperidin-4-amine?
N-(2,3-dimethylcyclohexyl)-1-pyridin-2-ylpiperidin-4-amine has a molecular weight of 287.45 g/mol, XLogP of 3.46, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylcyclohexyl)-1-pyridin-2-ylpiperidin-4-amine is sourced from PubChem (CID 43765340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).