2-methyl-N-[(3-methyl-1-pyridin-3-ylcyclobutyl)methyl]propan-1-amine

C15H24N2 — CID 80522198

IUPAC2-methyl-N-[(3-methyl-1-pyridin-3-ylcyclobutyl)methyl]propan-1-amine
SMILESCC(C)CNCC1(c2cccnc2)CC(C)C1
InChIInChI=1S/C15H24N2/c1-12(2)9-17-11-15(7-13(3)8-15)14-5-4-6-16-10-14/h4-6,10,12-13,17H,7-9,11H2,1-3H3
InChIKeyBIGDZTFOVWBHDC-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.99
Rot. Bonds5

About 2-methyl-N-[(3-methyl-1-pyridin-3-ylcyclobutyl)methyl]propan-1-amine

2-methyl-N-[(3-methyl-1-pyridin-3-ylcyclobutyl)methyl]propan-1-amine (PubChem CID 80522198) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 2-methyl-N-[(3-methyl-1-pyridin-3-ylcyclobutyl)methyl]propan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[(3-methyl-1-pyridin-3-ylcyclobutyl)methyl]propan-1-amine
PubChem CID80522198
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name2-methyl-N-[(3-methyl-1-pyridin-3-ylcyclobutyl)methyl]propan-1-amine
SMILESCC(C)CNCC1(c2cccnc2)CC(C)C1
InChIInChI=1S/C15H24N2/c1-12(2)9-17-11-15(7-13(3)8-15)14-5-4-6-16-10-14/h4-6,10,12-13,17H,7-9,11H2,1-3H3
InChIKeyBIGDZTFOVWBHDC-UHFFFAOYSA-N
XLogP2.99
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-N-[(1-pyridin-3-ylcyclohexyl)methyl]propan-1-amine
CID 80522632
2-methyl-N-[(2-methyl-2-pyridin-3-ylcyclopropyl)methyl]propan-1-amine
CID 62714424
N-[(3-ethyl-1-pyridin-3-ylcyclobutyl)methyl]propan-2-amine
CID 80522808
2-methoxy-N-[(4-methyl-1-pyridin-3-ylcyclohexyl)methyl]ethanamine
CID 80523629
N-methyl-1-(1-pyridin-3-ylcyclobutyl)methanamine
CID 80522291
N-methyl-1-(3-propyl-1-pyridin-3-ylcyclobutyl)methanamine
CID 80522419
N-[(2-pyridin-3-ylspiro[3.3]heptan-2-yl)methyl]ethanamine
CID 80522715
N-[[1-(3-methoxyphenyl)-3-propylcyclobutyl]methyl]-2-methylpropan-1-amine
CID 65010904
5-methyl-2-propan-2-yl-1-pyridin-3-ylcyclohexan-1-amine
CID 54861215
N-[[1-(4-bromophenyl)-3-tert-butylcyclobutyl]methyl]-2-methylpropan-1-amine
CID 65014923
2-methyl-N-[[2-(pyridin-3-ylmethyl)cyclobutyl]methyl]propan-1-amine
CID 104737366
N-(2-cyclopentyl-2-pyridin-3-ylethyl)-2-methylpropan-1-amine
CID 82937102

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(3-methyl-1-pyridin-3-ylcyclobutyl)methyl]propan-1-amine?
The IUPAC name of 2-methyl-N-[(3-methyl-1-pyridin-3-ylcyclobutyl)methyl]propan-1-amine (CID 80522198) is 2-methyl-N-[(3-methyl-1-pyridin-3-ylcyclobutyl)methyl]propan-1-amine.
What is the SMILES notation for 2-methyl-N-[(3-methyl-1-pyridin-3-ylcyclobutyl)methyl]propan-1-amine?
The canonical SMILES for 2-methyl-N-[(3-methyl-1-pyridin-3-ylcyclobutyl)methyl]propan-1-amine is CC(C)CNCC1(c2cccnc2)CC(C)C1.
What is the InChIKey of 2-methyl-N-[(3-methyl-1-pyridin-3-ylcyclobutyl)methyl]propan-1-amine?
The InChIKey is BIGDZTFOVWBHDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-12(2)9-17-11-15(7-13(3)8-15)14-5-4-6-16-10-14/h4-6,10,12-13,17H,7-9,11H2,1-3H3.
What are the key properties of 2-methyl-N-[(3-methyl-1-pyridin-3-ylcyclobutyl)methyl]propan-1-amine?
2-methyl-N-[(3-methyl-1-pyridin-3-ylcyclobutyl)methyl]propan-1-amine has a molecular weight of 232.37 g/mol, XLogP of 2.99, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(3-methyl-1-pyridin-3-ylcyclobutyl)methyl]propan-1-amine is sourced from PubChem (CID 80522198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).