1-phenyl-N-propyl-3-pyridin-2-ylpropan-1-amine

C17H22N2 — CID 105083650

IUPAC1-phenyl-N-propyl-3-pyridin-2-ylpropan-1-amine
SMILESCCCNC(CCc1ccccn1)c1ccccc1
InChIInChI=1S/C17H22N2/c1-2-13-19-17(15-8-4-3-5-9-15)12-11-16-10-6-7-14-18-16/h3-10,14,17,19H,2,11-13H2,1H3
InChIKeyAZNLBBQLBCTTHL-UHFFFAOYSA-N
MW254.38 g/mol
LogP3.76
Rot. Bonds7

About 1-phenyl-N-propyl-3-pyridin-2-ylpropan-1-amine

1-phenyl-N-propyl-3-pyridin-2-ylpropan-1-amine (PubChem CID 105083650) has the molecular formula C17H22N2 and a molecular weight of 254.38 g/mol. Its IUPAC name is 1-phenyl-N-propyl-3-pyridin-2-ylpropan-1-amine.

Molecular Properties

Compound Name1-phenyl-N-propyl-3-pyridin-2-ylpropan-1-amine
PubChem CID105083650
Molecular FormulaC17H22N2
Molecular Weight254.38 g/mol
Exact Mass254.18
IUPAC Name1-phenyl-N-propyl-3-pyridin-2-ylpropan-1-amine
SMILESCCCNC(CCc1ccccn1)c1ccccc1
InChIInChI=1S/C17H22N2/c1-2-13-19-17(15-8-4-3-5-9-15)12-11-16-10-6-7-14-18-16/h3-10,14,17,19H,2,11-13H2,1H3
InChIKeyAZNLBBQLBCTTHL-UHFFFAOYSA-N
XLogP3.76
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.38
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-fluorophenyl)-N-propyl-3-pyridin-2-ylpropan-1-amine
CID 105092665
1-(1-ethylimidazol-2-yl)-N-propyl-3-pyridin-2-ylpropan-1-amine
CID 105149718
1-(2,4-dimethylphenyl)-N-propyl-3-pyridin-2-ylpropan-1-amine
CID 105145212
1-(2-methylthiophen-3-yl)-N-propyl-3-pyridin-2-ylpropan-1-amine
CID 102841379
N-(1-phenyl-2-pyrimidin-2-ylethyl)propan-1-amine
CID 55163177
1-cyclopropyl-N-propyl-3-pyridin-2-ylpropan-1-amine
CID 105157131
3-phenyl-N-propyl-1-pyridin-2-ylpentan-2-amine
CID 104995300
7-methyl-N-propyl-1-pyridin-2-yloctan-3-amine
CID 105176977
1-(4-methylphenyl)-N-(2-pyridin-2-ylethyl)propan-1-amine
CID 43178454
6-methoxy-N-propyl-1-pyridin-2-ylhexan-3-amine
CID 105190112
N,N'-bis[(1R)-1-phenyl-2-pyridin-2-ylethyl]propane-1,3-diamine
CID 102584855
(1S)-N-ethyl-1-phenyl-2-pyridin-2-ylethanamine
CID 129365604

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-N-propyl-3-pyridin-2-ylpropan-1-amine?
The IUPAC name of 1-phenyl-N-propyl-3-pyridin-2-ylpropan-1-amine (CID 105083650) is 1-phenyl-N-propyl-3-pyridin-2-ylpropan-1-amine.
What is the SMILES notation for 1-phenyl-N-propyl-3-pyridin-2-ylpropan-1-amine?
The canonical SMILES for 1-phenyl-N-propyl-3-pyridin-2-ylpropan-1-amine is CCCNC(CCc1ccccn1)c1ccccc1.
What is the InChIKey of 1-phenyl-N-propyl-3-pyridin-2-ylpropan-1-amine?
The InChIKey is AZNLBBQLBCTTHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2/c1-2-13-19-17(15-8-4-3-5-9-15)12-11-16-10-6-7-14-18-16/h3-10,14,17,19H,2,11-13H2,1H3.
What are the key properties of 1-phenyl-N-propyl-3-pyridin-2-ylpropan-1-amine?
1-phenyl-N-propyl-3-pyridin-2-ylpropan-1-amine has a molecular weight of 254.38 g/mol, XLogP of 3.76, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-N-propyl-3-pyridin-2-ylpropan-1-amine is sourced from PubChem (CID 105083650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).