3-butyl-2-cyclopropyl-5-(6-methyl-3-pyridinyl)imidazol-4-amine

C16H22N4 — CID 104823262

IUPAC3-butyl-2-cyclopropyl-5-(6-methyl-3-pyridinyl)imidazol-4-amine
SMILESCCCCn1c(C2CC2)nc(-c2ccc(C)nc2)c1N
InChIInChI=1S/C16H22N4/c1-3-4-9-20-15(17)14(19-16(20)12-7-8-12)13-6-5-11(2)18-10-13/h5-6,10,12H,3-4,7-9,17H2,1-2H3
InChIKeyQLJCIRXLQCSCHM-UHFFFAOYSA-N
MW270.38 g/mol
LogP3.51
Rot. Bonds5

About 3-butyl-2-cyclopropyl-5-(6-methyl-3-pyridinyl)imidazol-4-amine

3-butyl-2-cyclopropyl-5-(6-methyl-3-pyridinyl)imidazol-4-amine (PubChem CID 104823262) has the molecular formula C16H22N4 and a molecular weight of 270.38 g/mol. Its IUPAC name is 3-butyl-2-cyclopropyl-5-(6-methyl-3-pyridinyl)imidazol-4-amine.

Molecular Properties

Compound Name3-butyl-2-cyclopropyl-5-(6-methyl-3-pyridinyl)imidazol-4-amine
PubChem CID104823262
Molecular FormulaC16H22N4
Molecular Weight270.38 g/mol
Exact Mass270.18
IUPAC Name3-butyl-2-cyclopropyl-5-(6-methyl-3-pyridinyl)imidazol-4-amine
SMILESCCCCn1c(C2CC2)nc(-c2ccc(C)nc2)c1N
InChIInChI=1S/C16H22N4/c1-3-4-9-20-15(17)14(19-16(20)12-7-8-12)13-6-5-11(2)18-10-13/h5-6,10,12H,3-4,7-9,17H2,1-2H3
InChIKeyQLJCIRXLQCSCHM-UHFFFAOYSA-N
XLogP3.51
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(5-amino-1-butyl-2-cyclopropylimidazol-4-yl)benzonitrile
CID 62220577
3-butyl-2-cyclopropyl-5-(2-methylphenyl)imidazol-4-amine
CID 62220576
2-cyclopropyl-5-(3,5-dimethylphenyl)-3-propylimidazol-4-amine
CID 62220740
3-butyl-5-(4-chloro-2-fluorophenyl)-2-cyclopropylimidazol-4-amine
CID 114859771
2,3-diethyl-5-(6-methyl-3-pyridinyl)imidazol-4-amine
CID 113457242
2-cyclopropyl-5-(4-ethylphenyl)-3-(2-methylpropyl)imidazol-4-amine
CID 62220950
5-(3-bromo-4-methoxyphenyl)-2-cyclopropyl-3-propylimidazol-4-amine
CID 62220561
2-cyclopropyl-5-(4-methylphenyl)-3-prop-2-enylimidazol-4-amine
CID 62220393
2-cyclopropyl-5-(2,4-dimethylphenyl)-3-propylimidazol-4-amine
CID 62220013
2-cyclopropyl-5-(3,4-difluorophenyl)-3-ethylimidazol-4-amine
CID 62220925
2-cyclopropyl-4-(6-methyl-3-pyridinyl)-1,3-thiazol-5-amine
CID 104823306
2-cyclopentyl-5-(2-methylphenyl)-3-propylimidazol-4-amine
CID 62219175

Frequently Asked Questions

What is the IUPAC name of 3-butyl-2-cyclopropyl-5-(6-methyl-3-pyridinyl)imidazol-4-amine?
The IUPAC name of 3-butyl-2-cyclopropyl-5-(6-methyl-3-pyridinyl)imidazol-4-amine (CID 104823262) is 3-butyl-2-cyclopropyl-5-(6-methyl-3-pyridinyl)imidazol-4-amine.
What is the SMILES notation for 3-butyl-2-cyclopropyl-5-(6-methyl-3-pyridinyl)imidazol-4-amine?
The canonical SMILES for 3-butyl-2-cyclopropyl-5-(6-methyl-3-pyridinyl)imidazol-4-amine is CCCCn1c(C2CC2)nc(-c2ccc(C)nc2)c1N.
What is the InChIKey of 3-butyl-2-cyclopropyl-5-(6-methyl-3-pyridinyl)imidazol-4-amine?
The InChIKey is QLJCIRXLQCSCHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4/c1-3-4-9-20-15(17)14(19-16(20)12-7-8-12)13-6-5-11(2)18-10-13/h5-6,10,12H,3-4,7-9,17H2,1-2H3.
What are the key properties of 3-butyl-2-cyclopropyl-5-(6-methyl-3-pyridinyl)imidazol-4-amine?
3-butyl-2-cyclopropyl-5-(6-methyl-3-pyridinyl)imidazol-4-amine has a molecular weight of 270.38 g/mol, XLogP of 3.51, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-butyl-2-cyclopropyl-5-(6-methyl-3-pyridinyl)imidazol-4-amine is sourced from PubChem (CID 104823262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).