3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-propylpropan-1-amine

C17H28N2O — CID 105025931

IUPAC3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-propylpropan-1-amine
SMILESCCCNC(CCC1CCCC1)c1cncc(OC)c1
InChIInChI=1S/C17H28N2O/c1-3-10-19-17(9-8-14-6-4-5-7-14)15-11-16(20-2)13-18-12-15/h11-14,17,19H,3-10H2,1-2H3
InChIKeyJKPVYOMQMWLDKX-UHFFFAOYSA-N
MW276.42 g/mol
LogP4.10
Rot. Bonds8

About 3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-propylpropan-1-amine

3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-propylpropan-1-amine (PubChem CID 105025931) has the molecular formula C17H28N2O and a molecular weight of 276.42 g/mol. Its IUPAC name is 3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-propylpropan-1-amine.

Molecular Properties

Compound Name3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-propylpropan-1-amine
PubChem CID105025931
Molecular FormulaC17H28N2O
Molecular Weight276.42 g/mol
Exact Mass276.22
IUPAC Name3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-propylpropan-1-amine
SMILESCCCNC(CCC1CCCC1)c1cncc(OC)c1
InChIInChI=1S/C17H28N2O/c1-3-10-19-17(9-8-14-6-4-5-7-14)15-11-16(20-2)13-18-12-15/h11-14,17,19H,3-10H2,1-2H3
InChIKeyJKPVYOMQMWLDKX-UHFFFAOYSA-N
XLogP4.10
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-methylpropan-1-amine
CID 105025992
1-(5-methoxy-3-pyridinyl)-N-propylhexan-1-amine
CID 105026088
N-[1-(5-methoxy-3-pyridinyl)-2-[(2-methylpropan-2-yl)oxy]ethyl]propan-1-amine
CID 105175348
1-(5-methoxy-3-pyridinyl)-N-propyl-3-pyridin-4-ylpropan-1-amine
CID 105175318
1-(5-methoxy-3-pyridinyl)-3,4,4-trimethyl-N-propylpentan-1-amine
CID 105026112
3-cycloheptyl-1-phenyl-N-propylpropan-1-amine
CID 82924096
3-cyclopentyl-1-(2-methoxyphenyl)-N-propylpropan-1-amine
CID 115792780
3-cyclopentyl-1-(4-fluorophenyl)-N-propylpropan-1-amine
CID 43494684
1-(5-methoxy-3-pyridinyl)-2,2-dimethyl-N-propylbutan-1-amine
CID 105026226
N-[(1-ethylcyclopentyl)-(5-methoxy-3-pyridinyl)methyl]propan-1-amine
CID 105026181
3-cyclopropyl-1-(2,5-dimethoxyphenyl)-N-propylpropan-1-amine
CID 104995107
N-[2-cycloheptyl-1-(5-fluoro-3-pyridinyl)ethyl]propan-1-amine
CID 115804158

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-propylpropan-1-amine?
The IUPAC name of 3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-propylpropan-1-amine (CID 105025931) is 3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-propylpropan-1-amine.
What is the SMILES notation for 3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-propylpropan-1-amine?
The canonical SMILES for 3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-propylpropan-1-amine is CCCNC(CCC1CCCC1)c1cncc(OC)c1.
What is the InChIKey of 3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-propylpropan-1-amine?
The InChIKey is JKPVYOMQMWLDKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O/c1-3-10-19-17(9-8-14-6-4-5-7-14)15-11-16(20-2)13-18-12-15/h11-14,17,19H,3-10H2,1-2H3.
What are the key properties of 3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-propylpropan-1-amine?
3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-propylpropan-1-amine has a molecular weight of 276.42 g/mol, XLogP of 4.10, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-propylpropan-1-amine is sourced from PubChem (CID 105025931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).