4-ethyl-1-phenyl-3-pyrimidin-2-ylpyrazol-5-amine

C15H15N5 — CID 114552617

IUPAC4-ethyl-1-phenyl-3-pyrimidin-2-ylpyrazol-5-amine
SMILESCCc1c(-c2ncccn2)nn(-c2ccccc2)c1N
InChIInChI=1S/C15H15N5/c1-2-12-13(15-17-9-6-10-18-15)19-20(14(12)16)11-7-4-3-5-8-11/h3-10H,2,16H2,1H3
InChIKeyQGKNLMQHCJVCBL-UHFFFAOYSA-N
MW265.32 g/mol
LogP2.47
Rot. Bonds3

About 4-ethyl-1-phenyl-3-pyrimidin-2-ylpyrazol-5-amine

4-ethyl-1-phenyl-3-pyrimidin-2-ylpyrazol-5-amine (PubChem CID 114552617) has the molecular formula C15H15N5 and a molecular weight of 265.32 g/mol. Its IUPAC name is 4-ethyl-1-phenyl-3-pyrimidin-2-ylpyrazol-5-amine.

Molecular Properties

Compound Name4-ethyl-1-phenyl-3-pyrimidin-2-ylpyrazol-5-amine
PubChem CID114552617
Molecular FormulaC15H15N5
Molecular Weight265.32 g/mol
Exact Mass265.13
IUPAC Name4-ethyl-1-phenyl-3-pyrimidin-2-ylpyrazol-5-amine
SMILESCCc1c(-c2ncccn2)nn(-c2ccccc2)c1N
InChIInChI=1S/C15H15N5/c1-2-12-13(15-17-9-6-10-18-15)19-20(14(12)16)11-7-4-3-5-8-11/h3-10H,2,16H2,1H3
InChIKeyQGKNLMQHCJVCBL-UHFFFAOYSA-N
XLogP2.47
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-ethyl-3-(4-methylphenyl)-1-phenylpyrazol-5-amine
CID 43670879
4-ethyl-3-(3-methylthiophen-2-yl)-1-phenylpyrazol-5-amine
CID 43670877
3-(5-amino-4-ethyl-1-phenylpyrazol-3-yl)-1H-pyridin-4-one
CID 136812338
1-phenyl-4-propyl-3-thiophen-3-ylpyrazol-5-amine
CID 79405275
4-ethyl-5-(2-methylcyclopentyl)-2-phenylpyrazol-3-amine
CID 107179201
4-methyl-1,3-diphenylpyrazol-5-amine
CID 43336769
3-pentan-3-yl-1-phenyl-4-propylpyrazol-5-amine
CID 79405595
2-(3,5-diamino-1-phenylpyrazol-4-yl)acetic acid
CID 115056344
4-(5-amino-4-methyl-1-phenylpyrazol-3-yl)benzoic acid
CID 145013429
3-(2-bromophenyl)-4-methyl-1-phenylpyrazol-5-amine
CID 43336800
4-ethyl-3,5-bis(4-methoxyphenyl)-1-phenylpyrazole
CID 19586817
5-amino-4-methyl-1-phenylpyrazole-3-carbohydrazide
CID 151938609

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-1-phenyl-3-pyrimidin-2-ylpyrazol-5-amine?
The IUPAC name of 4-ethyl-1-phenyl-3-pyrimidin-2-ylpyrazol-5-amine (CID 114552617) is 4-ethyl-1-phenyl-3-pyrimidin-2-ylpyrazol-5-amine.
What is the SMILES notation for 4-ethyl-1-phenyl-3-pyrimidin-2-ylpyrazol-5-amine?
The canonical SMILES for 4-ethyl-1-phenyl-3-pyrimidin-2-ylpyrazol-5-amine is CCc1c(-c2ncccn2)nn(-c2ccccc2)c1N.
What is the InChIKey of 4-ethyl-1-phenyl-3-pyrimidin-2-ylpyrazol-5-amine?
The InChIKey is QGKNLMQHCJVCBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5/c1-2-12-13(15-17-9-6-10-18-15)19-20(14(12)16)11-7-4-3-5-8-11/h3-10H,2,16H2,1H3.
What are the key properties of 4-ethyl-1-phenyl-3-pyrimidin-2-ylpyrazol-5-amine?
4-ethyl-1-phenyl-3-pyrimidin-2-ylpyrazol-5-amine has a molecular weight of 265.32 g/mol, XLogP of 2.47, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-1-phenyl-3-pyrimidin-2-ylpyrazol-5-amine is sourced from PubChem (CID 114552617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).