N-[1-(3-methylimidazol-4-yl)-2-pyridin-2-ylethyl]propan-1-amine

C14H20N4 — CID 82903504

IUPACN-[1-(3-methylimidazol-4-yl)-2-pyridin-2-ylethyl]propan-1-amine
SMILESCCCNC(Cc1ccccn1)c1cncn1C
InChIInChI=1S/C14H20N4/c1-3-7-17-13(14-10-15-11-18(14)2)9-12-6-4-5-8-16-12/h4-6,8,10-11,13,17H,3,7,9H2,1-2H3
InChIKeyQQLVZBFIEWSTDC-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.10
Rot. Bonds6

About N-[1-(3-methylimidazol-4-yl)-2-pyridin-2-ylethyl]propan-1-amine

N-[1-(3-methylimidazol-4-yl)-2-pyridin-2-ylethyl]propan-1-amine (PubChem CID 82903504) has the molecular formula C14H20N4 and a molecular weight of 244.34 g/mol. Its IUPAC name is N-[1-(3-methylimidazol-4-yl)-2-pyridin-2-ylethyl]propan-1-amine.

Molecular Properties

Compound NameN-[1-(3-methylimidazol-4-yl)-2-pyridin-2-ylethyl]propan-1-amine
PubChem CID82903504
Molecular FormulaC14H20N4
Molecular Weight244.34 g/mol
Exact Mass244.17
IUPAC NameN-[1-(3-methylimidazol-4-yl)-2-pyridin-2-ylethyl]propan-1-amine
SMILESCCCNC(Cc1ccccn1)c1cncn1C
InChIInChI=1S/C14H20N4/c1-3-7-17-13(14-10-15-11-18(14)2)9-12-6-4-5-8-16-12/h4-6,8,10-11,13,17H,3,7,9H2,1-2H3
InChIKeyQQLVZBFIEWSTDC-UHFFFAOYSA-N
XLogP2.10
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[1-(3-methylimidazol-4-yl)-2-pyridin-2-ylethyl]propan-1-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

N-ethyl-1-(3-methylimidazol-4-yl)-2-pyridin-2-ylethanamine
CID 82901884
[1-(3-methylimidazol-4-yl)-2-pyridin-2-ylethyl]hydrazine
CID 105264531
N-[1-(3-propyltriazol-4-yl)-2-pyridin-2-ylethyl]propan-1-amine
CID 114687156
N-[2-(2-methoxyphenyl)-1-(3-methylimidazol-4-yl)ethyl]propan-1-amine
CID 82903206
N-[1-(1,3-dimethylpyrazol-4-yl)-2-pyridin-2-ylethyl]propan-1-amine
CID 102803943
N-[1-(3-ethyl-1-methylpyrazol-4-yl)-2-pyridin-2-ylethyl]propan-1-amine
CID 102812507
3-ethyl-1-(3-methylimidazol-4-yl)-N-propylpentan-1-amine
CID 82923031
N-[2-(2-ethyl-1,2,4-triazol-3-yl)-1-(3-methylimidazol-4-yl)ethyl]propan-1-amine
CID 82902334
N-[1-(3,4-dimethylphenyl)-2-pyridin-2-ylethyl]propan-1-amine
CID 62550641
3-(1-methylimidazol-2-yl)-1-(3-methylimidazol-4-yl)-N-propylpropan-1-amine
CID 114530679
N-[2-(2-chloro-4-methylphenyl)-1-(3-methylimidazol-4-yl)ethyl]propan-1-amine
CID 106866577
1-(3-methylimidazol-4-yl)-N-propylpent-4-en-1-amine
CID 82902041

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-methylimidazol-4-yl)-2-pyridin-2-ylethyl]propan-1-amine?
The IUPAC name of N-[1-(3-methylimidazol-4-yl)-2-pyridin-2-ylethyl]propan-1-amine (CID 82903504) is N-[1-(3-methylimidazol-4-yl)-2-pyridin-2-ylethyl]propan-1-amine.
What is the SMILES notation for N-[1-(3-methylimidazol-4-yl)-2-pyridin-2-ylethyl]propan-1-amine?
The canonical SMILES for N-[1-(3-methylimidazol-4-yl)-2-pyridin-2-ylethyl]propan-1-amine is CCCNC(Cc1ccccn1)c1cncn1C.
What is the InChIKey of N-[1-(3-methylimidazol-4-yl)-2-pyridin-2-ylethyl]propan-1-amine?
The InChIKey is QQLVZBFIEWSTDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4/c1-3-7-17-13(14-10-15-11-18(14)2)9-12-6-4-5-8-16-12/h4-6,8,10-11,13,17H,3,7,9H2,1-2H3.
What are the key properties of N-[1-(3-methylimidazol-4-yl)-2-pyridin-2-ylethyl]propan-1-amine?
N-[1-(3-methylimidazol-4-yl)-2-pyridin-2-ylethyl]propan-1-amine has a molecular weight of 244.34 g/mol, XLogP of 2.10, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-methylimidazol-4-yl)-2-pyridin-2-ylethyl]propan-1-amine is sourced from PubChem (CID 82903504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).