3-cyclopropyl-5-(1-methylpyrazol-4-yl)-2-phenylimidazol-4-amine

C16H17N5 — CID 62222615

IUPAC3-cyclopropyl-5-(1-methylpyrazol-4-yl)-2-phenylimidazol-4-amine
SMILESCn1cc(-c2nc(-c3ccccc3)n(C3CC3)c2N)cn1
InChIInChI=1S/C16H17N5/c1-20-10-12(9-18-20)14-15(17)21(13-7-8-13)16(19-14)11-5-3-2-4-6-11/h2-6,9-10,13H,7-8,17H2,1H3
InChIKeyVTLHJAVZSPVBBV-UHFFFAOYSA-N
MW279.35 g/mol
LogP2.87
Rot. Bonds3

About 3-cyclopropyl-5-(1-methylpyrazol-4-yl)-2-phenylimidazol-4-amine

3-cyclopropyl-5-(1-methylpyrazol-4-yl)-2-phenylimidazol-4-amine (PubChem CID 62222615) has the molecular formula C16H17N5 and a molecular weight of 279.35 g/mol. Its IUPAC name is 3-cyclopropyl-5-(1-methylpyrazol-4-yl)-2-phenylimidazol-4-amine.

Molecular Properties

Compound Name3-cyclopropyl-5-(1-methylpyrazol-4-yl)-2-phenylimidazol-4-amine
PubChem CID62222615
Molecular FormulaC16H17N5
Molecular Weight279.35 g/mol
Exact Mass279.15
IUPAC Name3-cyclopropyl-5-(1-methylpyrazol-4-yl)-2-phenylimidazol-4-amine
SMILESCn1cc(-c2nc(-c3ccccc3)n(C3CC3)c2N)cn1
InChIInChI=1S/C16H17N5/c1-20-10-12(9-18-20)14-15(17)21(13-7-8-13)16(19-14)11-5-3-2-4-6-11/h2-6,9-10,13H,7-8,17H2,1H3
InChIKeyVTLHJAVZSPVBBV-UHFFFAOYSA-N
XLogP2.87
TPSA61.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.35
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-cyclopropyl-2-methyl-5-phenylimidazol-4-amine
CID 53275781
3-cyclopropyl-2-ethyl-5-phenylimidazol-4-amine
CID 62220629
3-cyclopropyl-5-pentan-3-yl-2-phenylimidazol-4-amine
CID 62222087
3-cyclopropyl-5-(3-methylsulfanylpropyl)-2-phenylimidazol-4-amine
CID 103090289
1-methyl-4-(4-phenylphenyl)pyrazole
CID 135064285
5-iodo-2-(1-methylpyrazol-4-yl)-6-phenylpyrimidin-4-amine
CID 66294304
ethane;4-methyl-3-(1-methylpyrazol-4-yl)-1-phenylpyrazol-5-amine
CID 142337289
3-cyclopropyl-5-(1-methoxypropan-2-yl)-2-phenylimidazol-4-amine
CID 116502906
4-cyclopropyl-3-(1-methylpyrazol-4-yl)-1H-1,2,4-triazole-5-thione
CID 79016011
6-N,6-N-dimethyl-2-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3,6-diamine
CID 55248780
2-tert-butyl-3-methyl-5-(1-methylpyrazol-4-yl)imidazol-4-amine
CID 62219674
3-cyclopropyl-5-(3-methylphenyl)-2-propan-2-ylimidazol-4-amine
CID 62220711

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-5-(1-methylpyrazol-4-yl)-2-phenylimidazol-4-amine?
The IUPAC name of 3-cyclopropyl-5-(1-methylpyrazol-4-yl)-2-phenylimidazol-4-amine (CID 62222615) is 3-cyclopropyl-5-(1-methylpyrazol-4-yl)-2-phenylimidazol-4-amine.
What is the SMILES notation for 3-cyclopropyl-5-(1-methylpyrazol-4-yl)-2-phenylimidazol-4-amine?
The canonical SMILES for 3-cyclopropyl-5-(1-methylpyrazol-4-yl)-2-phenylimidazol-4-amine is Cn1cc(-c2nc(-c3ccccc3)n(C3CC3)c2N)cn1.
What is the InChIKey of 3-cyclopropyl-5-(1-methylpyrazol-4-yl)-2-phenylimidazol-4-amine?
The InChIKey is VTLHJAVZSPVBBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5/c1-20-10-12(9-18-20)14-15(17)21(13-7-8-13)16(19-14)11-5-3-2-4-6-11/h2-6,9-10,13H,7-8,17H2,1H3.
What are the key properties of 3-cyclopropyl-5-(1-methylpyrazol-4-yl)-2-phenylimidazol-4-amine?
3-cyclopropyl-5-(1-methylpyrazol-4-yl)-2-phenylimidazol-4-amine has a molecular weight of 279.35 g/mol, XLogP of 2.87, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-5-(1-methylpyrazol-4-yl)-2-phenylimidazol-4-amine is sourced from PubChem (CID 62222615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).