[1-[(2-methylpiperidin-1-yl)methyl]cyclobutyl]methanamine

C12H24N2 — CID 82171577

IUPAC[1-[(2-methylpiperidin-1-yl)methyl]cyclobutyl]methanamine
SMILESCC1CCCCN1CC1(CN)CCC1
InChIInChI=1S/C12H24N2/c1-11-5-2-3-8-14(11)10-12(9-13)6-4-7-12/h11H,2-10,13H2,1H3
InChIKeyWGNUSWXLWOVFLX-UHFFFAOYSA-N
MW196.34 g/mol
LogP1.99
Rot. Bonds3

About [1-[(2-methylpiperidin-1-yl)methyl]cyclobutyl]methanamine

[1-[(2-methylpiperidin-1-yl)methyl]cyclobutyl]methanamine (PubChem CID 82171577) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is [1-[(2-methylpiperidin-1-yl)methyl]cyclobutyl]methanamine.

Molecular Properties

Compound Name[1-[(2-methylpiperidin-1-yl)methyl]cyclobutyl]methanamine
PubChem CID82171577
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name[1-[(2-methylpiperidin-1-yl)methyl]cyclobutyl]methanamine
SMILESCC1CCCCN1CC1(CN)CCC1
InChIInChI=1S/C12H24N2/c1-11-5-2-3-8-14(11)10-12(9-13)6-4-7-12/h11H,2-10,13H2,1H3
InChIKeyWGNUSWXLWOVFLX-UHFFFAOYSA-N
XLogP1.99
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[1-[(2-methylpyrrolidin-1-yl)methyl]cyclobutyl]methanamine
CID 115448882
[4-[(2-methylpyrrolidin-1-yl)methyl]oxan-4-yl]methanamine
CID 62390573
1-[(2-methylpiperidin-1-yl)methyl]cyclopropan-1-amine
CID 65457487
2-[1-[(2-methylpiperidin-1-yl)methyl]cyclopropyl]ethanethioamide
CID 65498283
2-[1-[(2-methylazepan-1-yl)methyl]cyclopropyl]ethanethioamide
CID 65496824
1-[1-[[1-(aminomethyl)cyclobutyl]methyl]pyrrolidin-2-yl]-N,N-dimethylmethanamine
CID 115449022
[1-[(4-methoxy-2-methylpiperidin-1-yl)methyl]cyclopentyl]methanamine
CID 114221232
[1-[(2,6-dimethylpiperidin-1-yl)methyl]cycloheptyl]methanamine
CID 115444989
[1-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-ylmethyl)cyclobutyl]methanamine
CID 115449090
[1-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]cyclopropyl]methanamine
CID 104967782
1-[(2-methylpiperidin-1-yl)methyl]cyclohexane-1-carbaldehyde
CID 62277310
1-[(2-methylpyrrolidin-1-yl)methyl]cyclopentan-1-amine
CID 60973694

Frequently Asked Questions

What is the IUPAC name of [1-[(2-methylpiperidin-1-yl)methyl]cyclobutyl]methanamine?
The IUPAC name of [1-[(2-methylpiperidin-1-yl)methyl]cyclobutyl]methanamine (CID 82171577) is [1-[(2-methylpiperidin-1-yl)methyl]cyclobutyl]methanamine.
What is the SMILES notation for [1-[(2-methylpiperidin-1-yl)methyl]cyclobutyl]methanamine?
The canonical SMILES for [1-[(2-methylpiperidin-1-yl)methyl]cyclobutyl]methanamine is CC1CCCCN1CC1(CN)CCC1.
What is the InChIKey of [1-[(2-methylpiperidin-1-yl)methyl]cyclobutyl]methanamine?
The InChIKey is WGNUSWXLWOVFLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-11-5-2-3-8-14(11)10-12(9-13)6-4-7-12/h11H,2-10,13H2,1H3.
What are the key properties of [1-[(2-methylpiperidin-1-yl)methyl]cyclobutyl]methanamine?
[1-[(2-methylpiperidin-1-yl)methyl]cyclobutyl]methanamine has a molecular weight of 196.34 g/mol, XLogP of 1.99, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(2-methylpiperidin-1-yl)methyl]cyclobutyl]methanamine is sourced from PubChem (CID 82171577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).