1-(2-cyclobutylphenyl)-N-methyl-1-(3-methyl-4-pyridinyl)methanamine

C18H22N2 — CID 114604437

IUPAC1-(2-cyclobutylphenyl)-N-methyl-1-(3-methyl-4-pyridinyl)methanamine
SMILESCNC(c1ccncc1C)c1ccccc1C1CCC1
InChIInChI=1S/C18H22N2/c1-13-12-20-11-10-15(13)18(19-2)17-9-4-3-8-16(17)14-6-5-7-14/h3-4,8-12,14,18-19H,5-7H2,1-2H3
InChIKeyIYZRHDOELPSKHX-UHFFFAOYSA-N
MW266.39 g/mol
LogP3.97
Rot. Bonds4

About 1-(2-cyclobutylphenyl)-N-methyl-1-(3-methyl-4-pyridinyl)methanamine

1-(2-cyclobutylphenyl)-N-methyl-1-(3-methyl-4-pyridinyl)methanamine (PubChem CID 114604437) has the molecular formula C18H22N2 and a molecular weight of 266.39 g/mol. Its IUPAC name is 1-(2-cyclobutylphenyl)-N-methyl-1-(3-methyl-4-pyridinyl)methanamine.

Molecular Properties

Compound Name1-(2-cyclobutylphenyl)-N-methyl-1-(3-methyl-4-pyridinyl)methanamine
PubChem CID114604437
Molecular FormulaC18H22N2
Molecular Weight266.39 g/mol
Exact Mass266.18
IUPAC Name1-(2-cyclobutylphenyl)-N-methyl-1-(3-methyl-4-pyridinyl)methanamine
SMILESCNC(c1ccncc1C)c1ccccc1C1CCC1
InChIInChI=1S/C18H22N2/c1-13-12-20-11-10-15(13)18(19-2)17-9-4-3-8-16(17)14-6-5-7-14/h3-4,8-12,14,18-19H,5-7H2,1-2H3
InChIKeyIYZRHDOELPSKHX-UHFFFAOYSA-N
XLogP3.97
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-cyclobutylphenyl)-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine
CID 105066142
1-(2-cyclobutylphenyl)-N-methyl-1-pyrazin-2-ylmethanamine
CID 114602735
1-(2-cyclobutylphenyl)-1-(2,4-dimethylphenyl)-N-methylmethanamine
CID 105052188
1-(2-cyclobutylphenyl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine
CID 114604500
1-(2-cyclobutylphenyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine
CID 105188892
1-(2-cyclobutylphenyl)-1-(3-fluoro-4-methylphenyl)-N-methylmethanamine
CID 114602710
[(3-chloro-4-pyridinyl)-(2-cyclobutylphenyl)methyl]hydrazine
CID 105341397
1-(4-bromophenyl)-1-(2-cyclobutylphenyl)-N-methylmethanamine
CID 114602530
1-(2-cyclobutylphenyl)-N-methyl-1-(1-methylcyclopentyl)methanamine
CID 105052427
1-(2-cyclobutylphenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine
CID 105188804
[(2-cyclobutylphenyl)-(4-fluoro-2-methylphenyl)methyl]hydrazine
CID 105256613
1-(2-cyclobutylphenyl)-1-cyclopropyl-N-methylmethanamine
CID 114602722

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclobutylphenyl)-N-methyl-1-(3-methyl-4-pyridinyl)methanamine?
The IUPAC name of 1-(2-cyclobutylphenyl)-N-methyl-1-(3-methyl-4-pyridinyl)methanamine (CID 114604437) is 1-(2-cyclobutylphenyl)-N-methyl-1-(3-methyl-4-pyridinyl)methanamine.
What is the SMILES notation for 1-(2-cyclobutylphenyl)-N-methyl-1-(3-methyl-4-pyridinyl)methanamine?
The canonical SMILES for 1-(2-cyclobutylphenyl)-N-methyl-1-(3-methyl-4-pyridinyl)methanamine is CNC(c1ccncc1C)c1ccccc1C1CCC1.
What is the InChIKey of 1-(2-cyclobutylphenyl)-N-methyl-1-(3-methyl-4-pyridinyl)methanamine?
The InChIKey is IYZRHDOELPSKHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2/c1-13-12-20-11-10-15(13)18(19-2)17-9-4-3-8-16(17)14-6-5-7-14/h3-4,8-12,14,18-19H,5-7H2,1-2H3.
What are the key properties of 1-(2-cyclobutylphenyl)-N-methyl-1-(3-methyl-4-pyridinyl)methanamine?
1-(2-cyclobutylphenyl)-N-methyl-1-(3-methyl-4-pyridinyl)methanamine has a molecular weight of 266.39 g/mol, XLogP of 3.97, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclobutylphenyl)-N-methyl-1-(3-methyl-4-pyridinyl)methanamine is sourced from PubChem (CID 114604437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).