1-[(3-methylcyclobutyl)methyl]piperidine

C11H21N — CID 120999950

IUPAC1-[(3-methylcyclobutyl)methyl]piperidine
SMILESCC1CC(CN2CCCCC2)C1
InChIInChI=1S/C11H21N/c1-10-7-11(8-10)9-12-5-3-2-4-6-12/h10-11H,2-9H2,1H3
InChIKeyVJEVMGZNDDEYQD-UHFFFAOYSA-N
MW167.30 g/mol
LogP2.52
Rot. Bonds2

About 1-[(3-methylcyclobutyl)methyl]piperidine

1-[(3-methylcyclobutyl)methyl]piperidine (PubChem CID 120999950) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is 1-[(3-methylcyclobutyl)methyl]piperidine.

Molecular Properties

Compound Name1-[(3-methylcyclobutyl)methyl]piperidine
PubChem CID120999950
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC Name1-[(3-methylcyclobutyl)methyl]piperidine
SMILESCC1CC(CN2CCCCC2)C1
InChIInChI=1S/C11H21N/c1-10-7-11(8-10)9-12-5-3-2-4-6-12/h10-11H,2-9H2,1H3
InChIKeyVJEVMGZNDDEYQD-UHFFFAOYSA-N
XLogP2.52
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-[[(3S)-3,6-dimethylcycloheptyl]methyl]piperidine
CID 137427496
1-[(4-methylcyclohexyl)methyl]piperidine
CID 58936411
(3aS,5R,6R,7aS)-2-(piperidin-1-ylmethyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indene-5,6-diol
CID 129404445
1-(oxetan-3-ylmethyl)piperidine
CID 57169736
[1-[(3-methylcyclobutyl)methyl]azetidin-3-yl]methanol
CID 164660332
3-(piperidin-1-ylmethyl)cyclopentane-1-carboxylic acid
CID 83820985
3-(piperidin-1-ylmethyl)cyclohexan-1-amine
CID 63044906
3-(azepan-1-ylmethyl)-1-methylazocane
CID 129168492
1-(cyclohexylmethyl)piperidine;ethane;ethanol
CID 143571293
4-methyl-1-[(3-methylcyclopentyl)methyl]-1,5-diazocane
CID 107415125
4-(piperidin-1-ylmethyl)cyclohexan-1-amine;hydrochloride
CID 175029660
1-(cyclopropylmethyl)-4-methylpiperidine
CID 54039585

Frequently Asked Questions

What is the IUPAC name of 1-[(3-methylcyclobutyl)methyl]piperidine?
The IUPAC name of 1-[(3-methylcyclobutyl)methyl]piperidine (CID 120999950) is 1-[(3-methylcyclobutyl)methyl]piperidine.
What is the SMILES notation for 1-[(3-methylcyclobutyl)methyl]piperidine?
The canonical SMILES for 1-[(3-methylcyclobutyl)methyl]piperidine is CC1CC(CN2CCCCC2)C1.
What is the InChIKey of 1-[(3-methylcyclobutyl)methyl]piperidine?
The InChIKey is VJEVMGZNDDEYQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N/c1-10-7-11(8-10)9-12-5-3-2-4-6-12/h10-11H,2-9H2,1H3.
What are the key properties of 1-[(3-methylcyclobutyl)methyl]piperidine?
1-[(3-methylcyclobutyl)methyl]piperidine has a molecular weight of 167.30 g/mol, XLogP of 2.52, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-methylcyclobutyl)methyl]piperidine is sourced from PubChem (CID 120999950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).