5-methyl-N-(3-phenylpropyl)pyridin-2-amine

C15H18N2 — CID 54931107

IUPAC5-methyl-N-(3-phenylpropyl)pyridin-2-amine
SMILESCc1ccc(NCCCc2ccccc2)nc1
InChIInChI=1S/C15H18N2/c1-13-9-10-15(17-12-13)16-11-5-8-14-6-3-2-4-7-14/h2-4,6-7,9-10,12H,5,8,11H2,1H3,(H,16,17)
InChIKeyZGZJDEYSONRVAQ-UHFFFAOYSA-N
MW226.32 g/mol
LogP3.43
Rot. Bonds5

About 5-methyl-N-(3-phenylpropyl)pyridin-2-amine

5-methyl-N-(3-phenylpropyl)pyridin-2-amine (PubChem CID 54931107) has the molecular formula C15H18N2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 5-methyl-N-(3-phenylpropyl)pyridin-2-amine.

Molecular Properties

Compound Name5-methyl-N-(3-phenylpropyl)pyridin-2-amine
PubChem CID54931107
Molecular FormulaC15H18N2
Molecular Weight226.32 g/mol
Exact Mass226.15
IUPAC Name5-methyl-N-(3-phenylpropyl)pyridin-2-amine
SMILESCc1ccc(NCCCc2ccccc2)nc1
InChIInChI=1S/C15H18N2/c1-13-9-10-15(17-12-13)16-11-5-8-14-6-3-2-4-7-14/h2-4,6-7,9-10,12H,5,8,11H2,1H3,(H,16,17)
InChIKeyZGZJDEYSONRVAQ-UHFFFAOYSA-N
XLogP3.43
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-chloro-N-(3-phenylpropyl)pyridin-2-amine
CID 54931106
5-methyl-N-(3-phenylpropyl)pyrimidin-2-amine
CID 63208283
N-(3-phenylpropyl)-5-(trifluoromethyl)pyridin-2-amine
CID 60631694
N-(4-chlorobutyl)-5-methylpyridin-2-amine
CID 106845125
N-methyl-N'-(5-methyl-2-pyridinyl)pentane-1,5-diamine
CID 143011658
2-amino-N-[3-[(5-methyl-2-pyridinyl)amino]propyl]-3-phenylpropanamide
CID 119888012
N,N-diethyl-6-(3-phenylpropylamino)pyridine-3-carboxamide
CID 109160732
N-phenyl-6-(3-phenylpropylamino)pyridine-3-carboxamide
CID 109160785
N-(3-ethoxypropyl)-5-methylpyridin-2-amine
CID 29271693
N-(4-chloropentyl)-5-methylpyridin-2-amine
CID 106124548
4-methyl-N-[6-(3-phenylpropylamino)pyridazin-3-yl]benzamide
CID 113044092
N'-(5-methyl-2-pyridinyl)-N-(2-phenylethyl)oxamide
CID 44997210

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(3-phenylpropyl)pyridin-2-amine?
The IUPAC name of 5-methyl-N-(3-phenylpropyl)pyridin-2-amine (CID 54931107) is 5-methyl-N-(3-phenylpropyl)pyridin-2-amine.
What is the SMILES notation for 5-methyl-N-(3-phenylpropyl)pyridin-2-amine?
The canonical SMILES for 5-methyl-N-(3-phenylpropyl)pyridin-2-amine is Cc1ccc(NCCCc2ccccc2)nc1.
What is the InChIKey of 5-methyl-N-(3-phenylpropyl)pyridin-2-amine?
The InChIKey is ZGZJDEYSONRVAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2/c1-13-9-10-15(17-12-13)16-11-5-8-14-6-3-2-4-7-14/h2-4,6-7,9-10,12H,5,8,11H2,1H3,(H,16,17).
What are the key properties of 5-methyl-N-(3-phenylpropyl)pyridin-2-amine?
5-methyl-N-(3-phenylpropyl)pyridin-2-amine has a molecular weight of 226.32 g/mol, XLogP of 3.43, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(3-phenylpropyl)pyridin-2-amine is sourced from PubChem (CID 54931107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).