1-(1-ethylimidazol-2-yl)-N-propyl-3-pyridin-2-ylpropan-1-amine

C16H24N4 — CID 105149718

IUPAC1-(1-ethylimidazol-2-yl)-N-propyl-3-pyridin-2-ylpropan-1-amine
SMILESCCCNC(CCc1ccccn1)c1nccn1CC
InChIInChI=1S/C16H24N4/c1-3-10-18-15(16-19-12-13-20(16)4-2)9-8-14-7-5-6-11-17-14/h5-7,11-13,15,18H,3-4,8-10H2,1-2H3
InChIKeyBZXRPBKAMXYSGA-UHFFFAOYSA-N
MW272.40 g/mol
LogP2.97
Rot. Bonds8

About 1-(1-ethylimidazol-2-yl)-N-propyl-3-pyridin-2-ylpropan-1-amine

1-(1-ethylimidazol-2-yl)-N-propyl-3-pyridin-2-ylpropan-1-amine (PubChem CID 105149718) has the molecular formula C16H24N4 and a molecular weight of 272.40 g/mol. Its IUPAC name is 1-(1-ethylimidazol-2-yl)-N-propyl-3-pyridin-2-ylpropan-1-amine.

Molecular Properties

Compound Name1-(1-ethylimidazol-2-yl)-N-propyl-3-pyridin-2-ylpropan-1-amine
PubChem CID105149718
Molecular FormulaC16H24N4
Molecular Weight272.40 g/mol
Exact Mass272.20
IUPAC Name1-(1-ethylimidazol-2-yl)-N-propyl-3-pyridin-2-ylpropan-1-amine
SMILESCCCNC(CCc1ccccn1)c1nccn1CC
InChIInChI=1S/C16H24N4/c1-3-10-18-15(16-19-12-13-20(16)4-2)9-8-14-7-5-6-11-17-14/h5-7,11-13,15,18H,3-4,8-10H2,1-2H3
InChIKeyBZXRPBKAMXYSGA-UHFFFAOYSA-N
XLogP2.97
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.40
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-phenyl-N-propyl-3-pyridin-2-ylpropan-1-amine
CID 105083650
N-ethyl-1-(1-ethylimidazol-2-yl)-2-pyridin-2-ylethanamine
CID 63968337
N-[1-(1-ethylimidazol-2-yl)-2-methoxyethyl]propan-1-amine
CID 63967707
N-[1-(1-ethylimidazol-2-yl)-2-(2-methylphenyl)sulfanylethyl]propan-1-amine
CID 66096354
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
1-(3-fluorophenyl)-N-propyl-3-pyridin-2-ylpropan-1-amine
CID 105092665
N-ethyl-1-(1-ethylimidazol-2-yl)-3-(2-methylphenyl)propan-1-amine
CID 105149854
N-[1-(2-methoxy-3-pyridinyl)-2-pyridin-2-ylethyl]propan-1-amine
CID 105158151
N-[1-(1-ethylimidazol-2-yl)-2-propan-2-ylsulfanylethyl]propan-1-amine
CID 65131968
1-(1-ethylimidazol-2-yl)-4-methoxy-3-methyl-N-propylbutan-1-amine
CID 105149787
1-(1-ethylimidazol-2-yl)-2-pyridin-2-ylethanol
CID 63977321

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethylimidazol-2-yl)-N-propyl-3-pyridin-2-ylpropan-1-amine?
The IUPAC name of 1-(1-ethylimidazol-2-yl)-N-propyl-3-pyridin-2-ylpropan-1-amine (CID 105149718) is 1-(1-ethylimidazol-2-yl)-N-propyl-3-pyridin-2-ylpropan-1-amine.
What is the SMILES notation for 1-(1-ethylimidazol-2-yl)-N-propyl-3-pyridin-2-ylpropan-1-amine?
The canonical SMILES for 1-(1-ethylimidazol-2-yl)-N-propyl-3-pyridin-2-ylpropan-1-amine is CCCNC(CCc1ccccn1)c1nccn1CC.
What is the InChIKey of 1-(1-ethylimidazol-2-yl)-N-propyl-3-pyridin-2-ylpropan-1-amine?
The InChIKey is BZXRPBKAMXYSGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4/c1-3-10-18-15(16-19-12-13-20(16)4-2)9-8-14-7-5-6-11-17-14/h5-7,11-13,15,18H,3-4,8-10H2,1-2H3.
What are the key properties of 1-(1-ethylimidazol-2-yl)-N-propyl-3-pyridin-2-ylpropan-1-amine?
1-(1-ethylimidazol-2-yl)-N-propyl-3-pyridin-2-ylpropan-1-amine has a molecular weight of 272.40 g/mol, XLogP of 2.97, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethylimidazol-2-yl)-N-propyl-3-pyridin-2-ylpropan-1-amine is sourced from PubChem (CID 105149718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).