6-(2-methylimidazol-1-yl)-N-pentan-2-ylpyridin-3-amine

C14H20N4 — CID 43748679

IUPAC6-(2-methylimidazol-1-yl)-N-pentan-2-ylpyridin-3-amine
SMILESCCCC(C)Nc1ccc(-n2ccnc2C)nc1
InChIInChI=1S/C14H20N4/c1-4-5-11(2)17-13-6-7-14(16-10-13)18-9-8-15-12(18)3/h6-11,17H,4-5H2,1-3H3
InChIKeyOJYNIABNOBDNHL-UHFFFAOYSA-N
MW244.34 g/mol
LogP3.18
Rot. Bonds5

About 6-(2-methylimidazol-1-yl)-N-pentan-2-ylpyridin-3-amine

6-(2-methylimidazol-1-yl)-N-pentan-2-ylpyridin-3-amine (PubChem CID 43748679) has the molecular formula C14H20N4 and a molecular weight of 244.34 g/mol. Its IUPAC name is 6-(2-methylimidazol-1-yl)-N-pentan-2-ylpyridin-3-amine.

Molecular Properties

Compound Name6-(2-methylimidazol-1-yl)-N-pentan-2-ylpyridin-3-amine
PubChem CID43748679
Molecular FormulaC14H20N4
Molecular Weight244.34 g/mol
Exact Mass244.17
IUPAC Name6-(2-methylimidazol-1-yl)-N-pentan-2-ylpyridin-3-amine
SMILESCCCC(C)Nc1ccc(-n2ccnc2C)nc1
InChIInChI=1S/C14H20N4/c1-4-5-11(2)17-13-6-7-14(16-10-13)18-9-8-15-12(18)3/h6-11,17H,4-5H2,1-3H3
InChIKeyOJYNIABNOBDNHL-UHFFFAOYSA-N
XLogP3.18
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Glu-P 2
CID 49970
4-(1H-imidazol-1-yl)aniline
CID 320165
4-(2-methyl-1H-imidazol-1-yl)aniline
CID 3157478
Imidazo(4,5-b)pyridine
CID 67504
Imidazo(1,2-a)pyridine
CID 78960
2-(1H-imidazol-2-yl)pyridine
CID 589313
Guanidine, 2-cyano-1-neopentyl-3-(3-pyridyl)-
CID 3042790
N1,N1-Dimethyl-N2-2-pyridinyl-1,2-ethanediamine
CID 90273
3H-Imidazo(4,5-b)pyridin-2-amine
CID 179897
[2-(1H-imidazol-1-yl)pyridin-4-yl]methanamine
CID 16782615
1',3'-Dihydrospiro(cyclohexane-1,2'-(2H)imidazo(4,5-b)pyridine)
CID 589729
2-N-phenylpyridine-2,3-diamine
CID 10679091

Frequently Asked Questions

What is the IUPAC name of 6-(2-methylimidazol-1-yl)-N-pentan-2-ylpyridin-3-amine?
The IUPAC name of 6-(2-methylimidazol-1-yl)-N-pentan-2-ylpyridin-3-amine (CID 43748679) is 6-(2-methylimidazol-1-yl)-N-pentan-2-ylpyridin-3-amine.
What is the SMILES notation for 6-(2-methylimidazol-1-yl)-N-pentan-2-ylpyridin-3-amine?
The canonical SMILES for 6-(2-methylimidazol-1-yl)-N-pentan-2-ylpyridin-3-amine is CCCC(C)Nc1ccc(-n2ccnc2C)nc1.
What is the InChIKey of 6-(2-methylimidazol-1-yl)-N-pentan-2-ylpyridin-3-amine?
The InChIKey is OJYNIABNOBDNHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4/c1-4-5-11(2)17-13-6-7-14(16-10-13)18-9-8-15-12(18)3/h6-11,17H,4-5H2,1-3H3.
What are the key properties of 6-(2-methylimidazol-1-yl)-N-pentan-2-ylpyridin-3-amine?
6-(2-methylimidazol-1-yl)-N-pentan-2-ylpyridin-3-amine has a molecular weight of 244.34 g/mol, XLogP of 3.18, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methylimidazol-1-yl)-N-pentan-2-ylpyridin-3-amine is sourced from PubChem (CID 43748679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).