1-[(4-methylcyclohexyl)methyl]piperidine

C13H25N — CID 58936411

IUPAC1-[(4-methylcyclohexyl)methyl]piperidine
SMILESCC1CCC(CN2CCCCC2)CC1
InChIInChI=1S/C13H25N/c1-12-5-7-13(8-6-12)11-14-9-3-2-4-10-14/h12-13H,2-11H2,1H3
InChIKeyMXAYDRFMHGZAGW-UHFFFAOYSA-N
MW195.35 g/mol
LogP3.30
Rot. Bonds2

About 1-[(4-methylcyclohexyl)methyl]piperidine

1-[(4-methylcyclohexyl)methyl]piperidine (PubChem CID 58936411) has the molecular formula C13H25N and a molecular weight of 195.35 g/mol. Its IUPAC name is 1-[(4-methylcyclohexyl)methyl]piperidine.

Molecular Properties

Compound Name1-[(4-methylcyclohexyl)methyl]piperidine
PubChem CID58936411
Molecular FormulaC13H25N
Molecular Weight195.35 g/mol
Exact Mass195.20
IUPAC Name1-[(4-methylcyclohexyl)methyl]piperidine
SMILESCC1CCC(CN2CCCCC2)CC1
InChIInChI=1S/C13H25N/c1-12-5-7-13(8-6-12)11-14-9-3-2-4-10-14/h12-13H,2-11H2,1H3
InChIKeyMXAYDRFMHGZAGW-UHFFFAOYSA-N
XLogP3.30
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.35
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-[[(3S)-3,6-dimethylcycloheptyl]methyl]piperidine
CID 137427496
1-(cyclopropylmethyl)-4-methylpiperidine
CID 54039585
ethane;methane;4-methyl-1-[(4-methylcyclohexyl)methyl]piperidine
CID 167474854
4-methyl-1-[(4-methylcyclohexyl)methyl]-1,5-diazocane
CID 63243515
1-[(3-methylcyclobutyl)methyl]piperidine
CID 120999950
4-(piperidin-1-ylmethyl)cyclohexan-1-amine;hydrochloride
CID 175029660
1-(cyclopropylmethyl)-4-(4-methylcyclohexyl)piperazine
CID 20761838
1-[(4-ethylcyclohexyl)methyl]-4-methylpiperidine
CID 167550394
1-(cyclopropylmethyl)-4-(4-methylcyclohexyl)piperazine;methane
CID 160896318
3-methyl-1-[(4-methylcyclohexyl)methyl]-1,4-diazepane
CID 64951574
1-(cyclohexylmethyl)piperidine;ethane;ethanol
CID 143571293
1-[1-[(4-methylcyclohexyl)methyl]piperidin-4-yl]propan-1-one
CID 167284458

Frequently Asked Questions

What is the IUPAC name of 1-[(4-methylcyclohexyl)methyl]piperidine?
The IUPAC name of 1-[(4-methylcyclohexyl)methyl]piperidine (CID 58936411) is 1-[(4-methylcyclohexyl)methyl]piperidine.
What is the SMILES notation for 1-[(4-methylcyclohexyl)methyl]piperidine?
The canonical SMILES for 1-[(4-methylcyclohexyl)methyl]piperidine is CC1CCC(CN2CCCCC2)CC1.
What is the InChIKey of 1-[(4-methylcyclohexyl)methyl]piperidine?
The InChIKey is MXAYDRFMHGZAGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N/c1-12-5-7-13(8-6-12)11-14-9-3-2-4-10-14/h12-13H,2-11H2,1H3.
What are the key properties of 1-[(4-methylcyclohexyl)methyl]piperidine?
1-[(4-methylcyclohexyl)methyl]piperidine has a molecular weight of 195.35 g/mol, XLogP of 3.30, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-methylcyclohexyl)methyl]piperidine is sourced from PubChem (CID 58936411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).