1-[(2-methylcyclohexyl)methyl]-2-piperidin-2-ylpiperidine

C18H34N2 — CID 163172242

IUPAC1-[(2-methylcyclohexyl)methyl]-2-piperidin-2-ylpiperidine
SMILESCC1CCCCC1CN1CCCCC1C1CCCCN1
InChIInChI=1S/C18H34N2/c1-15-8-2-3-9-16(15)14-20-13-7-5-11-18(20)17-10-4-6-12-19-17/h15-19H,2-14H2,1H3
InChIKeyGXRHVVCWVPRFON-UHFFFAOYSA-N
MW278.48 g/mol
LogP3.81
Rot. Bonds3

About 1-[(2-methylcyclohexyl)methyl]-2-piperidin-2-ylpiperidine

1-[(2-methylcyclohexyl)methyl]-2-piperidin-2-ylpiperidine (PubChem CID 163172242) has the molecular formula C18H34N2 and a molecular weight of 278.48 g/mol. Its IUPAC name is 1-[(2-methylcyclohexyl)methyl]-2-piperidin-2-ylpiperidine.

Molecular Properties

Compound Name1-[(2-methylcyclohexyl)methyl]-2-piperidin-2-ylpiperidine
PubChem CID163172242
Molecular FormulaC18H34N2
Molecular Weight278.48 g/mol
Exact Mass278.27
IUPAC Name1-[(2-methylcyclohexyl)methyl]-2-piperidin-2-ylpiperidine
SMILESCC1CCCCC1CN1CCCCC1C1CCCCN1
InChIInChI=1S/C18H34N2/c1-15-8-2-3-9-16(15)14-20-13-7-5-11-18(20)17-10-4-6-12-19-17/h15-19H,2-14H2,1H3
InChIKeyGXRHVVCWVPRFON-UHFFFAOYSA-N
XLogP3.81
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.48
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(2-fluorocyclohexyl)methyl]-2-piperidin-2-ylpiperidine
CID 163123470
4-(cyclopropylmethyl)-2,3,4a,5,6,7,8,8a-octahydro-1H-quinoxaline
CID 130581230
1-[(5,5-dimethyloxolan-2-yl)methyl]-2-pyrrolidin-2-ylpiperidine
CID 116522866
2-methyl-2,8-diazabicyclo[5.5.0]dodecane
CID 130417846
1-(2-fluoroethyl)-2-pyrrolidin-2-ylpyrrolidine
CID 80693813
3-cyclopropyl-1-[(2-methylcyclohexyl)methyl]-1,4-diazepane
CID 64944041
(1S,7R)-2-benzyl-2,8-diazabicyclo[5.5.0]dodecane
CID 178143612
(2R)-2-[(2S)-1-methylpiperidin-2-yl]azepane
CID 124718938
1-(2-propan-2-ylsulfonylethyl)-2-pyrrolidin-2-ylpiperidine
CID 106727939
1-(2-ethylcyclohexyl)-2-pyrrolidin-2-ylpiperidine
CID 63863432
1-(2-pyrrolidin-2-ylpiperidin-1-yl)butan-2-ol
CID 63254458
3-methyl-1-[(2-methylcyclohexyl)methyl]piperidin-2-amine
CID 163122949

Frequently Asked Questions

What is the IUPAC name of 1-[(2-methylcyclohexyl)methyl]-2-piperidin-2-ylpiperidine?
The IUPAC name of 1-[(2-methylcyclohexyl)methyl]-2-piperidin-2-ylpiperidine (CID 163172242) is 1-[(2-methylcyclohexyl)methyl]-2-piperidin-2-ylpiperidine.
What is the SMILES notation for 1-[(2-methylcyclohexyl)methyl]-2-piperidin-2-ylpiperidine?
The canonical SMILES for 1-[(2-methylcyclohexyl)methyl]-2-piperidin-2-ylpiperidine is CC1CCCCC1CN1CCCCC1C1CCCCN1.
What is the InChIKey of 1-[(2-methylcyclohexyl)methyl]-2-piperidin-2-ylpiperidine?
The InChIKey is GXRHVVCWVPRFON-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N2/c1-15-8-2-3-9-16(15)14-20-13-7-5-11-18(20)17-10-4-6-12-19-17/h15-19H,2-14H2,1H3.
What are the key properties of 1-[(2-methylcyclohexyl)methyl]-2-piperidin-2-ylpiperidine?
1-[(2-methylcyclohexyl)methyl]-2-piperidin-2-ylpiperidine has a molecular weight of 278.48 g/mol, XLogP of 3.81, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-methylcyclohexyl)methyl]-2-piperidin-2-ylpiperidine is sourced from PubChem (CID 163172242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).