2-methyl-N-[(2-methyl-3-pyridinyl)methyl]cyclobutan-1-amine

C12H18N2 — CID 130552141

IUPAC2-methyl-N-[(2-methyl-3-pyridinyl)methyl]cyclobutan-1-amine
SMILESCc1ncccc1CNC1CCC1C
InChIInChI=1S/C12H18N2/c1-9-5-6-12(9)14-8-11-4-3-7-13-10(11)2/h3-4,7,9,12,14H,5-6,8H2,1-2H3
InChIKeyQXKHEWYEJODBNI-UHFFFAOYSA-N
MW190.29 g/mol
LogP2.28
Rot. Bonds3

About 2-methyl-N-[(2-methyl-3-pyridinyl)methyl]cyclobutan-1-amine

2-methyl-N-[(2-methyl-3-pyridinyl)methyl]cyclobutan-1-amine (PubChem CID 130552141) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 2-methyl-N-[(2-methyl-3-pyridinyl)methyl]cyclobutan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[(2-methyl-3-pyridinyl)methyl]cyclobutan-1-amine
PubChem CID130552141
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name2-methyl-N-[(2-methyl-3-pyridinyl)methyl]cyclobutan-1-amine
SMILESCc1ncccc1CNC1CCC1C
InChIInChI=1S/C12H18N2/c1-9-5-6-12(9)14-8-11-4-3-7-13-10(11)2/h3-4,7,9,12,14H,5-6,8H2,1-2H3
InChIKeyQXKHEWYEJODBNI-UHFFFAOYSA-N
XLogP2.28
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-N-[(2-methyl-3-pyridinyl)methyl]oxolan-3-amine
CID 115868289
(2S,3S)-2-(3,4-difluorophenyl)-N-[(2-methyl-3-pyridinyl)methyl]oxolan-3-amine
CID 97336733
2-methyl-N-[(2-methylphenyl)methyl]cyclohexan-1-amine
CID 43081283
N-[(1-cyclopropylcyclopropyl)methyl]-1-(2-methyl-3-pyridinyl)methanamine
CID 115757819
2-cyclopentyl-N-[(2-methyl-3-pyridinyl)methyl]ethanamine;hydrochloride
CID 115611231
2-[1-[(1R,2S)-2-[(2-methyl-3-pyridinyl)methylamino]cyclohexyl]triazol-4-yl]propan-2-ol
CID 128995082
N-[(5-chloroquinolin-8-yl)methyl]-2-methylcyclohexan-1-amine
CID 115958999
N-[(2-chlorophenyl)methyl]-2-methylcyclohexan-1-amine
CID 43079937
N-[(3-fluoro-2-pyridinyl)methyl]-2-methylcyclopentan-1-amine
CID 115757258
N-[(2-methyl-3-pyridinyl)methyl]butan-2-amine
CID 78928581
N-[(2-methyl-3-pyridinyl)methyl]pyridin-2-amine
CID 115692595
N-[(2-bromophenyl)methyl]-2,3-dimethylcyclopentan-1-amine
CID 64909294

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(2-methyl-3-pyridinyl)methyl]cyclobutan-1-amine?
The IUPAC name of 2-methyl-N-[(2-methyl-3-pyridinyl)methyl]cyclobutan-1-amine (CID 130552141) is 2-methyl-N-[(2-methyl-3-pyridinyl)methyl]cyclobutan-1-amine.
What is the SMILES notation for 2-methyl-N-[(2-methyl-3-pyridinyl)methyl]cyclobutan-1-amine?
The canonical SMILES for 2-methyl-N-[(2-methyl-3-pyridinyl)methyl]cyclobutan-1-amine is Cc1ncccc1CNC1CCC1C.
What is the InChIKey of 2-methyl-N-[(2-methyl-3-pyridinyl)methyl]cyclobutan-1-amine?
The InChIKey is QXKHEWYEJODBNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c1-9-5-6-12(9)14-8-11-4-3-7-13-10(11)2/h3-4,7,9,12,14H,5-6,8H2,1-2H3.
What are the key properties of 2-methyl-N-[(2-methyl-3-pyridinyl)methyl]cyclobutan-1-amine?
2-methyl-N-[(2-methyl-3-pyridinyl)methyl]cyclobutan-1-amine has a molecular weight of 190.29 g/mol, XLogP of 2.28, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(2-methyl-3-pyridinyl)methyl]cyclobutan-1-amine is sourced from PubChem (CID 130552141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).