1-(1-methylimidazol-2-yl)-N-propyl-5-pyridin-4-ylpentan-3-amine

C17H26N4 — CID 105187730

IUPAC1-(1-methylimidazol-2-yl)-N-propyl-5-pyridin-4-ylpentan-3-amine
SMILESCCCNC(CCc1ccncc1)CCc1nccn1C
InChIInChI=1S/C17H26N4/c1-3-10-19-16(5-4-15-8-11-18-12-9-15)6-7-17-20-13-14-21(17)2/h8-9,11-14,16,19H,3-7,10H2,1-2H3
InChIKeyMXKLFULUYGIAAH-UHFFFAOYSA-N
MW286.42 g/mol
LogP2.75
Rot. Bonds9

About 1-(1-methylimidazol-2-yl)-N-propyl-5-pyridin-4-ylpentan-3-amine

1-(1-methylimidazol-2-yl)-N-propyl-5-pyridin-4-ylpentan-3-amine (PubChem CID 105187730) has the molecular formula C17H26N4 and a molecular weight of 286.42 g/mol. Its IUPAC name is 1-(1-methylimidazol-2-yl)-N-propyl-5-pyridin-4-ylpentan-3-amine.

Molecular Properties

Compound Name1-(1-methylimidazol-2-yl)-N-propyl-5-pyridin-4-ylpentan-3-amine
PubChem CID105187730
Molecular FormulaC17H26N4
Molecular Weight286.42 g/mol
Exact Mass286.22
IUPAC Name1-(1-methylimidazol-2-yl)-N-propyl-5-pyridin-4-ylpentan-3-amine
SMILESCCCNC(CCc1ccncc1)CCc1nccn1C
InChIInChI=1S/C17H26N4/c1-3-10-19-16(5-4-15-8-11-18-12-9-15)6-7-17-20-13-14-21(17)2/h8-9,11-14,16,19H,3-7,10H2,1-2H3
InChIKeyMXKLFULUYGIAAH-UHFFFAOYSA-N
XLogP2.75
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(1-methylimidazol-2-yl)-N-propyl-5-pyridin-4-ylpentan-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-cyclopentylsulfanyl-4-(1-methylimidazol-2-yl)-N-propylbutan-2-amine
CID 114530277
N-propyl-1-pyridin-4-ylhept-6-yn-3-amine
CID 105149151
1,1,1-trifluoro-4-(1-methylimidazol-2-yl)-N-propylbutan-2-amine
CID 105049992
N-ethyl-6-methyl-1-(1-methylimidazol-2-yl)heptan-3-amine
CID 114530055
4-(1-methylimidazol-2-yl)-1-pyridin-4-ylbutan-2-amine
CID 114530112
1-(2-methyltetrazol-5-yl)-N-propyl-4-pyridin-4-ylbutan-2-amine
CID 107065461
3-(1-methylimidazol-2-yl)-1-(3-methylimidazol-4-yl)-N-propylpropan-1-amine
CID 114530679
1-(3-ethyl-1-methylpyrazol-5-yl)-3-(1-methylimidazol-2-yl)-N-propylpropan-1-amine
CID 105187793
3-(1-methylimidazol-2-yl)-1-(oxan-4-yl)-N-propylpropan-1-amine
CID 114530301
N-[2-(1-methylimidazol-2-yl)ethyl]-4-phenylbutan-2-amine
CID 61213282
N-propyl-1-pyridin-3-yl-4-pyridin-4-ylbutan-2-amine
CID 105179991
1-(oxan-4-yl)-N-propyl-4-pyridin-4-ylbutan-2-amine
CID 105138737

Frequently Asked Questions

What is the IUPAC name of 1-(1-methylimidazol-2-yl)-N-propyl-5-pyridin-4-ylpentan-3-amine?
The IUPAC name of 1-(1-methylimidazol-2-yl)-N-propyl-5-pyridin-4-ylpentan-3-amine (CID 105187730) is 1-(1-methylimidazol-2-yl)-N-propyl-5-pyridin-4-ylpentan-3-amine.
What is the SMILES notation for 1-(1-methylimidazol-2-yl)-N-propyl-5-pyridin-4-ylpentan-3-amine?
The canonical SMILES for 1-(1-methylimidazol-2-yl)-N-propyl-5-pyridin-4-ylpentan-3-amine is CCCNC(CCc1ccncc1)CCc1nccn1C.
What is the InChIKey of 1-(1-methylimidazol-2-yl)-N-propyl-5-pyridin-4-ylpentan-3-amine?
The InChIKey is MXKLFULUYGIAAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4/c1-3-10-19-16(5-4-15-8-11-18-12-9-15)6-7-17-20-13-14-21(17)2/h8-9,11-14,16,19H,3-7,10H2,1-2H3.
What are the key properties of 1-(1-methylimidazol-2-yl)-N-propyl-5-pyridin-4-ylpentan-3-amine?
1-(1-methylimidazol-2-yl)-N-propyl-5-pyridin-4-ylpentan-3-amine has a molecular weight of 286.42 g/mol, XLogP of 2.75, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylimidazol-2-yl)-N-propyl-5-pyridin-4-ylpentan-3-amine is sourced from PubChem (CID 105187730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).