5-(3-cyclopropylimidazol-4-yl)-2-ethyl-3-(2-methylpropyl)imidazol-4-amine

C15H23N5 — CID 66164499

IUPAC5-(3-cyclopropylimidazol-4-yl)-2-ethyl-3-(2-methylpropyl)imidazol-4-amine
SMILESCCc1nc(-c2cncn2C2CC2)c(N)n1CC(C)C
InChIInChI=1S/C15H23N5/c1-4-13-18-14(15(16)19(13)8-10(2)3)12-7-17-9-20(12)11-5-6-11/h7,9-11H,4-6,8,16H2,1-3H3
InChIKeyJLDSKNJQNOLKBW-UHFFFAOYSA-N
MW273.38 g/mol
LogP2.88
Rot. Bonds5

About 5-(3-cyclopropylimidazol-4-yl)-2-ethyl-3-(2-methylpropyl)imidazol-4-amine

5-(3-cyclopropylimidazol-4-yl)-2-ethyl-3-(2-methylpropyl)imidazol-4-amine (PubChem CID 66164499) has the molecular formula C15H23N5 and a molecular weight of 273.38 g/mol. Its IUPAC name is 5-(3-cyclopropylimidazol-4-yl)-2-ethyl-3-(2-methylpropyl)imidazol-4-amine.

Molecular Properties

Compound Name5-(3-cyclopropylimidazol-4-yl)-2-ethyl-3-(2-methylpropyl)imidazol-4-amine
PubChem CID66164499
Molecular FormulaC15H23N5
Molecular Weight273.38 g/mol
Exact Mass273.20
IUPAC Name5-(3-cyclopropylimidazol-4-yl)-2-ethyl-3-(2-methylpropyl)imidazol-4-amine
SMILESCCc1nc(-c2cncn2C2CC2)c(N)n1CC(C)C
InChIInChI=1S/C15H23N5/c1-4-13-18-14(15(16)19(13)8-10(2)3)12-7-17-9-20(12)11-5-6-11/h7,9-11H,4-6,8,16H2,1-3H3
InChIKeyJLDSKNJQNOLKBW-UHFFFAOYSA-N
XLogP2.88
TPSA61.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-[2-(1,3-Dimethylimidazol-1-ium-4-yl)ethylimino]-3,7-dimethylpurin-2-amine
CID 177644514
4,4'-Bisimidazole, 2,2'-difluoro-1,1'-dimethyl-
CID 607734
6-(2,3-dimethylimidazol-4-yl)-N-[(3R,4S)-4-fluoropyrrolidin-3-yl]pyrazin-2-amine
CID 58303266
6-(2,3-dimethylimidazol-4-yl)-N-[(3S,4S)-4-fluoropyrrolidin-3-yl]pyrazin-2-amine
CID 58303288
6-(2,3-dimethylimidazol-4-yl)-N-(4-fluoropyrrolidin-3-yl)pyrazin-2-amine
CID 76753399
2-methyl-5-(2-methyl-1H-imidazol-5-yl)-1H-imidazole
CID 11030144
2-ethyl-5-(2-ethyl-1H-imidazol-5-yl)-1H-imidazole
CID 86083948
3,3'-dimethyl-3H,3'H-4,4'-biimidazole
CID 138115344
6-(2,3-dimethylimidazol-4-yl)-N-[(3R)-piperidin-3-yl]pyrazin-2-amine
CID 44815157
1-Tert-butyl-4-(3-methylimidazol-4-yl)triazole
CID 57624572
6-(2,3-dimethylimidazol-4-yl)-N-[(3R)-pyrrolidin-3-yl]pyrazin-2-amine
CID 58303236
9-(1-Methylpyrrol-2-yl)-3,6-dihydropurin-2-amine
CID 69978222

Frequently Asked Questions

What is the IUPAC name of 5-(3-cyclopropylimidazol-4-yl)-2-ethyl-3-(2-methylpropyl)imidazol-4-amine?
The IUPAC name of 5-(3-cyclopropylimidazol-4-yl)-2-ethyl-3-(2-methylpropyl)imidazol-4-amine (CID 66164499) is 5-(3-cyclopropylimidazol-4-yl)-2-ethyl-3-(2-methylpropyl)imidazol-4-amine.
What is the SMILES notation for 5-(3-cyclopropylimidazol-4-yl)-2-ethyl-3-(2-methylpropyl)imidazol-4-amine?
The canonical SMILES for 5-(3-cyclopropylimidazol-4-yl)-2-ethyl-3-(2-methylpropyl)imidazol-4-amine is CCc1nc(-c2cncn2C2CC2)c(N)n1CC(C)C.
What is the InChIKey of 5-(3-cyclopropylimidazol-4-yl)-2-ethyl-3-(2-methylpropyl)imidazol-4-amine?
The InChIKey is JLDSKNJQNOLKBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5/c1-4-13-18-14(15(16)19(13)8-10(2)3)12-7-17-9-20(12)11-5-6-11/h7,9-11H,4-6,8,16H2,1-3H3.
What are the key properties of 5-(3-cyclopropylimidazol-4-yl)-2-ethyl-3-(2-methylpropyl)imidazol-4-amine?
5-(3-cyclopropylimidazol-4-yl)-2-ethyl-3-(2-methylpropyl)imidazol-4-amine has a molecular weight of 273.38 g/mol, XLogP of 2.88, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-cyclopropylimidazol-4-yl)-2-ethyl-3-(2-methylpropyl)imidazol-4-amine is sourced from PubChem (CID 66164499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).