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

C16H20N2 — CID 122602486

IUPAC2-methyl-N-[(3-pyridin-2-ylphenyl)methyl]propan-1-amine
SMILESCC(C)CNCc1cccc(-c2ccccn2)c1
InChIInChI=1S/C16H20N2/c1-13(2)11-17-12-14-6-5-7-15(10-14)16-8-3-4-9-18-16/h3-10,13,17H,11-12H2,1-2H3
InChIKeyWCGYVIDRYWQSFL-UHFFFAOYSA-N
MW240.35 g/mol
LogP3.49
Rot. Bonds5

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

2-methyl-N-[(3-pyridin-2-ylphenyl)methyl]propan-1-amine (PubChem CID 122602486) has the molecular formula C16H20N2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 2-methyl-N-[(3-pyridin-2-ylphenyl)methyl]propan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[(3-pyridin-2-ylphenyl)methyl]propan-1-amine
PubChem CID122602486
Molecular FormulaC16H20N2
Molecular Weight240.35 g/mol
Exact Mass240.16
IUPAC Name2-methyl-N-[(3-pyridin-2-ylphenyl)methyl]propan-1-amine
SMILESCC(C)CNCc1cccc(-c2ccccn2)c1
InChIInChI=1S/C16H20N2/c1-13(2)11-17-12-14-6-5-7-15(10-14)16-8-3-4-9-18-16/h3-10,13,17H,11-12H2,1-2H3
InChIKeyWCGYVIDRYWQSFL-UHFFFAOYSA-N
XLogP3.49
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(+-)-Chlorpheniramine
CID 2725
Ethionamide
CID 2761171
Triprolidine
CID 5282443
Brompheniramine
CID 6834
Anabasine
CID 205586
(+-)-Dimethindene
CID 21855
Nornicotine
CID 91462
Dexchlorpheniramine
CID 33036
Pheniramine
CID 4761
Prothionamide
CID 666418
3-(Pyrrolidin-2-yl)pyridine
CID 412
(+-)-Anabasine
CID 2181

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(3-pyridin-2-ylphenyl)methyl]propan-1-amine?
The IUPAC name of 2-methyl-N-[(3-pyridin-2-ylphenyl)methyl]propan-1-amine (CID 122602486) is 2-methyl-N-[(3-pyridin-2-ylphenyl)methyl]propan-1-amine.
What is the SMILES notation for 2-methyl-N-[(3-pyridin-2-ylphenyl)methyl]propan-1-amine?
The canonical SMILES for 2-methyl-N-[(3-pyridin-2-ylphenyl)methyl]propan-1-amine is CC(C)CNCc1cccc(-c2ccccn2)c1.
What is the InChIKey of 2-methyl-N-[(3-pyridin-2-ylphenyl)methyl]propan-1-amine?
The InChIKey is WCGYVIDRYWQSFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2/c1-13(2)11-17-12-14-6-5-7-15(10-14)16-8-3-4-9-18-16/h3-10,13,17H,11-12H2,1-2H3.
What are the key properties of 2-methyl-N-[(3-pyridin-2-ylphenyl)methyl]propan-1-amine?
2-methyl-N-[(3-pyridin-2-ylphenyl)methyl]propan-1-amine has a molecular weight of 240.35 g/mol, XLogP of 3.49, 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-pyridin-2-ylphenyl)methyl]propan-1-amine is sourced from PubChem (CID 122602486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).