6-[2-(4-methylcyclohexyl)-3-piperidin-2-ylpropyl]-1,2-dihydropyridine

C20H34N2 — CID 5247287

IUPAC6-[2-(4-methylcyclohexyl)-3-piperidin-2-ylpropyl]-1,2-dihydropyridine
SMILESCC1CCC(C(CC2=CC=CCN2)CC2CCCCN2)CC1
InChIInChI=1S/C20H34N2/c1-16-8-10-17(11-9-16)18(14-19-6-2-4-12-21-19)15-20-7-3-5-13-22-20/h2,4,6,16-18,20-22H,3,5,7-15H2,1H3
InChIKeyXXHBCHHCMGVINH-UHFFFAOYSA-N
MW302.51 g/mol
LogP4.39
Rot. Bonds5

About 6-[2-(4-methylcyclohexyl)-3-piperidin-2-ylpropyl]-1,2-dihydropyridine

6-[2-(4-methylcyclohexyl)-3-piperidin-2-ylpropyl]-1,2-dihydropyridine (PubChem CID 5247287) has the molecular formula C20H34N2 and a molecular weight of 302.51 g/mol. Its IUPAC name is 6-[2-(4-methylcyclohexyl)-3-piperidin-2-ylpropyl]-1,2-dihydropyridine.

Molecular Properties

Compound Name6-[2-(4-methylcyclohexyl)-3-piperidin-2-ylpropyl]-1,2-dihydropyridine
PubChem CID5247287
Molecular FormulaC20H34N2
Molecular Weight302.51 g/mol
Exact Mass302.27
IUPAC Name6-[2-(4-methylcyclohexyl)-3-piperidin-2-ylpropyl]-1,2-dihydropyridine
SMILESCC1CCC(C(CC2=CC=CCN2)CC2CCCCN2)CC1
InChIInChI=1S/C20H34N2/c1-16-8-10-17(11-9-16)18(14-19-6-2-4-12-21-19)15-20-7-3-5-13-22-20/h2,4,6,16-18,20-22H,3,5,7-15H2,1H3
InChIKeyXXHBCHHCMGVINH-UHFFFAOYSA-N
XLogP4.39
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.51
LogP ≤ 54.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(1,2-dihydropyridin-6-ylmethylamino)ethyl]-N'-(piperidin-2-ylmethyl)ethane-1,2-diamine
CID 6396326
2-(2,2-dicyclohexylethyl)piperidine;hydrochloride
CID 71369675
4-methyl-N-(1-pyrrolidin-2-ylpropan-2-yl)cyclohexan-1-amine
CID 79541223
1-cyclobutyl-N,N-dimethyl-2-piperidin-2-ylethanamine
CID 116906819
1-(azepan-2-yl)-N-[(1R)-1-cyclohexylethyl]propan-2-amine
CID 81384452
1-piperidin-2-ylpropan-2-yl formate
CID 175103047
2-[2-(3-methylphenoxy)propyl]piperidine
CID 105493585
1-(1,2-dihydropyridin-6-yl)-1-piperidin-2-ylpropan-1-ol
CID 5251420
5-methyl-2-(piperidin-2-ylmethyl)piperidine
CID 121010596
N-(1-piperidin-2-ylpropan-2-yl)cyclohexanamine
CID 79549011
4-(1-piperidin-2-ylpropan-2-yloxy)phenol
CID 105496690
N-(4-methylcyclohexyl)-1-piperidin-2-ylmethanesulfonamide
CID 54973720

Frequently Asked Questions

What is the IUPAC name of 6-[2-(4-methylcyclohexyl)-3-piperidin-2-ylpropyl]-1,2-dihydropyridine?
The IUPAC name of 6-[2-(4-methylcyclohexyl)-3-piperidin-2-ylpropyl]-1,2-dihydropyridine (CID 5247287) is 6-[2-(4-methylcyclohexyl)-3-piperidin-2-ylpropyl]-1,2-dihydropyridine.
What is the SMILES notation for 6-[2-(4-methylcyclohexyl)-3-piperidin-2-ylpropyl]-1,2-dihydropyridine?
The canonical SMILES for 6-[2-(4-methylcyclohexyl)-3-piperidin-2-ylpropyl]-1,2-dihydropyridine is CC1CCC(C(CC2=CC=CCN2)CC2CCCCN2)CC1.
What is the InChIKey of 6-[2-(4-methylcyclohexyl)-3-piperidin-2-ylpropyl]-1,2-dihydropyridine?
The InChIKey is XXHBCHHCMGVINH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H34N2/c1-16-8-10-17(11-9-16)18(14-19-6-2-4-12-21-19)15-20-7-3-5-13-22-20/h2,4,6,16-18,20-22H,3,5,7-15H2,1H3.
What are the key properties of 6-[2-(4-methylcyclohexyl)-3-piperidin-2-ylpropyl]-1,2-dihydropyridine?
6-[2-(4-methylcyclohexyl)-3-piperidin-2-ylpropyl]-1,2-dihydropyridine has a molecular weight of 302.51 g/mol, XLogP of 4.39, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(4-methylcyclohexyl)-3-piperidin-2-ylpropyl]-1,2-dihydropyridine is sourced from PubChem (CID 5247287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).