1,5-dimethyl-N-(1-phenylethyl)pyrazol-4-amine

C13H17N3 — CID 115923286

IUPAC1,5-dimethyl-N-(1-phenylethyl)pyrazol-4-amine
SMILESCc1c(NC(C)c2ccccc2)cnn1C
InChIInChI=1S/C13H17N3/c1-10(12-7-5-4-6-8-12)15-13-9-14-16(3)11(13)2/h4-10,15H,1-3H3
InChIKeyNGLMNFDQASFXJB-UHFFFAOYSA-N
MW215.30 g/mol
LogP2.90
Rot. Bonds3

About 1,5-dimethyl-N-(1-phenylethyl)pyrazol-4-amine

1,5-dimethyl-N-(1-phenylethyl)pyrazol-4-amine (PubChem CID 115923286) has the molecular formula C13H17N3 and a molecular weight of 215.30 g/mol. Its IUPAC name is 1,5-dimethyl-N-(1-phenylethyl)pyrazol-4-amine.

Molecular Properties

Compound Name1,5-dimethyl-N-(1-phenylethyl)pyrazol-4-amine
PubChem CID115923286
Molecular FormulaC13H17N3
Molecular Weight215.30 g/mol
Exact Mass215.14
IUPAC Name1,5-dimethyl-N-(1-phenylethyl)pyrazol-4-amine
SMILESCc1c(NC(C)c2ccccc2)cnn1C
InChIInChI=1S/C13H17N3/c1-10(12-7-5-4-6-8-12)15-13-9-14-16(3)11(13)2/h4-10,15H,1-3H3
InChIKeyNGLMNFDQASFXJB-UHFFFAOYSA-N
XLogP2.90
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-methoxybutan-2-yl)-1,5-dimethylpyrazol-4-amine
CID 115923272
4-chloro-5-(1-phenylethylamino)-2-propan-2-ylpyridazin-3-one
CID 114431888
2-amino-N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]-2-phenylacetamide;hydrochloride
CID 119293154
1,5-dimethyl-N-(1-thiophen-3-ylpropan-2-yl)pyrazol-4-amine
CID 115923213
5-[1-(4-bromophenyl)ethylamino]-4-chloro-2-methylpyridazin-3-one
CID 115577699
4-chloro-5-[[(1R)-1-(4-fluorophenyl)ethyl]amino]-2-methylpyridazin-3-one
CID 51932024
2-bromo-N-[(1S)-1-phenylethyl]aniline;hydrochloride
CID 172882995
2-tert-butyl-N-(1-phenylethyl)aniline
CID 43226869
2-phenyl-N-(1-phenylethyl)aniline
CID 43078706
4-chloro-5-(1-phenylethylamino)-2-prop-2-enylpyridazin-3-one
CID 114431890
1-(1,5-dimethylpyrazol-4-yl)-3-(2-methylphenyl)thiourea
CID 17264839
4-bromo-5-[1-(4-ethylphenyl)ethylamino]-2-methylpyridazin-3-one
CID 115623969

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-N-(1-phenylethyl)pyrazol-4-amine?
The IUPAC name of 1,5-dimethyl-N-(1-phenylethyl)pyrazol-4-amine (CID 115923286) is 1,5-dimethyl-N-(1-phenylethyl)pyrazol-4-amine.
What is the SMILES notation for 1,5-dimethyl-N-(1-phenylethyl)pyrazol-4-amine?
The canonical SMILES for 1,5-dimethyl-N-(1-phenylethyl)pyrazol-4-amine is Cc1c(NC(C)c2ccccc2)cnn1C.
What is the InChIKey of 1,5-dimethyl-N-(1-phenylethyl)pyrazol-4-amine?
The InChIKey is NGLMNFDQASFXJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3/c1-10(12-7-5-4-6-8-12)15-13-9-14-16(3)11(13)2/h4-10,15H,1-3H3.
What are the key properties of 1,5-dimethyl-N-(1-phenylethyl)pyrazol-4-amine?
1,5-dimethyl-N-(1-phenylethyl)pyrazol-4-amine has a molecular weight of 215.30 g/mol, XLogP of 2.90, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-N-(1-phenylethyl)pyrazol-4-amine is sourced from PubChem (CID 115923286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).