2,5-dimethyl-N-[(2S)-2-phenylpropyl]pyrazol-3-amine

C14H19N3 — CID 129403163

IUPAC2,5-dimethyl-N-[(2S)-2-phenylpropyl]pyrazol-3-amine
SMILESCc1cc(NC[C@@H](C)c2ccccc2)n(C)n1
InChIInChI=1S/C14H19N3/c1-11(13-7-5-4-6-8-13)10-15-14-9-12(2)16-17(14)3/h4-9,11,15H,10H2,1-3H3/t11-/m1/s1
InChIKeyFTJAIOTVDIUVRO-LLVKDONJSA-N
MW229.33 g/mol
LogP2.94
Rot. Bonds4

About 2,5-dimethyl-N-[(2S)-2-phenylpropyl]pyrazol-3-amine

2,5-dimethyl-N-[(2S)-2-phenylpropyl]pyrazol-3-amine (PubChem CID 129403163) has the molecular formula C14H19N3 and a molecular weight of 229.33 g/mol. Its IUPAC name is 2,5-dimethyl-N-[(2S)-2-phenylpropyl]pyrazol-3-amine.

Molecular Properties

Compound Name2,5-dimethyl-N-[(2S)-2-phenylpropyl]pyrazol-3-amine
PubChem CID129403163
Molecular FormulaC14H19N3
Molecular Weight229.33 g/mol
Exact Mass229.16
IUPAC Name2,5-dimethyl-N-[(2S)-2-phenylpropyl]pyrazol-3-amine
SMILESCc1cc(NC[C@@H](C)c2ccccc2)n(C)n1
InChIInChI=1S/C14H19N3/c1-11(13-7-5-4-6-8-13)10-15-14-9-12(2)16-17(14)3/h4-9,11,15H,10H2,1-3H3/t11-/m1/s1
InChIKeyFTJAIOTVDIUVRO-LLVKDONJSA-N
XLogP2.94
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.33
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2,5-dimethyl-N-[(2S)-2-phenylpropyl]pyrazol-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-1-N-(2,5-dimethylpyrazol-3-yl)-3-methylbutane-1,2-diamine
CID 130523401
1,3-dimethyl-N-(2-phenylpropyl)pyrazolo[5,4-b]pyridin-5-amine
CID 43725542
N-(2,5-dimethylpyrazol-3-yl)-2,2-diphenylacetamide
CID 42109659
1-N-(2,5-dimethylpyrazol-3-yl)-3-methoxypropane-1,2-diamine
CID 103568986
1-(2,5-dimethylpyrazol-3-yl)-3-(2-phenylbutyl)urea
CID 51080232
1-butyl-5-methyl-N-(2-phenylpropyl)pyrazol-3-amine
CID 19626837
(1R)-N-[(2,5-dimethylpyrazol-3-yl)methyl]-1-phenylethanamine
CID 79025656
6-chloro-2-methyl-N-(2-phenylpropyl)pyrimidin-4-amine
CID 113230295
2,4,6-trimethyl-N-(2-phenylpropyl)aniline
CID 55192336
2-methyl-N-(2-phenylpropyl)quinolin-4-amine
CID 104591691
5-methyl-3-N-(2-phenylpropyl)benzene-1,3-diamine
CID 113430182
4-bromo-3-methyl-N-(2-phenylpropyl)aniline
CID 43102221

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-N-[(2S)-2-phenylpropyl]pyrazol-3-amine?
The IUPAC name of 2,5-dimethyl-N-[(2S)-2-phenylpropyl]pyrazol-3-amine (CID 129403163) is 2,5-dimethyl-N-[(2S)-2-phenylpropyl]pyrazol-3-amine.
What is the SMILES notation for 2,5-dimethyl-N-[(2S)-2-phenylpropyl]pyrazol-3-amine?
The canonical SMILES for 2,5-dimethyl-N-[(2S)-2-phenylpropyl]pyrazol-3-amine is Cc1cc(NC[C@@H](C)c2ccccc2)n(C)n1.
What is the InChIKey of 2,5-dimethyl-N-[(2S)-2-phenylpropyl]pyrazol-3-amine?
The InChIKey is FTJAIOTVDIUVRO-LLVKDONJSA-N. The full InChI is InChI=1S/C14H19N3/c1-11(13-7-5-4-6-8-13)10-15-14-9-12(2)16-17(14)3/h4-9,11,15H,10H2,1-3H3/t11-/m1/s1.
What are the key properties of 2,5-dimethyl-N-[(2S)-2-phenylpropyl]pyrazol-3-amine?
2,5-dimethyl-N-[(2S)-2-phenylpropyl]pyrazol-3-amine has a molecular weight of 229.33 g/mol, XLogP of 2.94, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-N-[(2S)-2-phenylpropyl]pyrazol-3-amine is sourced from PubChem (CID 129403163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).