(2R)-2-amino-N-[2-(2-phenylethyl)pyrazol-3-yl]propanamide

C14H18N4O — CID 119282442

IUPAC(2R)-2-amino-N-[2-(2-phenylethyl)pyrazol-3-yl]propanamide
SMILESC[C@@H](N)C(=O)Nc1ccnn1CCc1ccccc1
InChIInChI=1S/C14H18N4O/c1-11(15)14(19)17-13-7-9-16-18(13)10-8-12-5-3-2-4-6-12/h2-7,9,11H,8,10,15H2,1H3,(H,17,19)/t11-/m1/s1
InChIKeySJMCTMSVSFKZHZ-LLVKDONJSA-N
MW258.33 g/mol
LogP1.41
Rot. Bonds5

About (2R)-2-amino-N-[2-(2-phenylethyl)pyrazol-3-yl]propanamide

(2R)-2-amino-N-[2-(2-phenylethyl)pyrazol-3-yl]propanamide (PubChem CID 119282442) has the molecular formula C14H18N4O and a molecular weight of 258.33 g/mol. Its IUPAC name is (2R)-2-amino-N-[2-(2-phenylethyl)pyrazol-3-yl]propanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-[2-(2-phenylethyl)pyrazol-3-yl]propanamide
PubChem CID119282442
Molecular FormulaC14H18N4O
Molecular Weight258.33 g/mol
Exact Mass258.15
IUPAC Name(2R)-2-amino-N-[2-(2-phenylethyl)pyrazol-3-yl]propanamide
SMILESC[C@@H](N)C(=O)Nc1ccnn1CCc1ccccc1
InChIInChI=1S/C14H18N4O/c1-11(15)14(19)17-13-7-9-16-18(13)10-8-12-5-3-2-4-6-12/h2-7,9,11H,8,10,15H2,1H3,(H,17,19)/t11-/m1/s1
InChIKeySJMCTMSVSFKZHZ-LLVKDONJSA-N
XLogP1.41
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.33
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-[2-(2-phenylethyl)pyrazol-3-yl]pentanamide
CID 120559913
2-hydroxy-2-phenyl-N-[2-(2-phenylethyl)pyrazol-3-yl]acetamide
CID 111432601
4-(methylamino)-N-[2-(2-phenylethyl)pyrazol-3-yl]butanamide;hydrochloride
CID 119710915
N-[2-(2-phenylethyl)pyrazol-3-yl]-3-piperidin-4-ylbutanamide;hydrochloride
CID 119710933
2-hydroxy-N-[2-(2-phenylethyl)pyrazol-3-yl]cyclopentane-1-carboxamide
CID 110014410
4-methyl-N-[2-(2-phenylethyl)pyrazol-3-yl]-1,4-diazepane-1-carboxamide
CID 86800393
N-[2-(2-phenylethyl)pyrazol-3-yl]-2-prop-2-enylsulfanylacetamide
CID 51103469
(2S)-N-(2-benzylpyrazol-3-yl)-2-phenoxypropanamide
CID 30804831
9-amino-N-[2-(2-phenylethyl)pyrazol-3-yl]bicyclo[3.3.1]nonane-3-carboxamide
CID 120988251
N-[2-(2-phenylethyl)pyrazol-3-yl]pyrrolidine-3-carboxamide
CID 119710942
(3R)-1-(2-ethylphenyl)-5-oxo-N-[2-(2-phenylethyl)pyrazol-3-yl]pyrrolidine-3-carboxamide
CID 52509395
(2R)-2-amino-N-(4-phenylbutan-2-yl)propanamide
CID 14620809

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[2-(2-phenylethyl)pyrazol-3-yl]propanamide?
The IUPAC name of (2R)-2-amino-N-[2-(2-phenylethyl)pyrazol-3-yl]propanamide (CID 119282442) is (2R)-2-amino-N-[2-(2-phenylethyl)pyrazol-3-yl]propanamide.
What is the SMILES notation for (2R)-2-amino-N-[2-(2-phenylethyl)pyrazol-3-yl]propanamide?
The canonical SMILES for (2R)-2-amino-N-[2-(2-phenylethyl)pyrazol-3-yl]propanamide is C[C@@H](N)C(=O)Nc1ccnn1CCc1ccccc1.
What is the InChIKey of (2R)-2-amino-N-[2-(2-phenylethyl)pyrazol-3-yl]propanamide?
The InChIKey is SJMCTMSVSFKZHZ-LLVKDONJSA-N. The full InChI is InChI=1S/C14H18N4O/c1-11(15)14(19)17-13-7-9-16-18(13)10-8-12-5-3-2-4-6-12/h2-7,9,11H,8,10,15H2,1H3,(H,17,19)/t11-/m1/s1.
What are the key properties of (2R)-2-amino-N-[2-(2-phenylethyl)pyrazol-3-yl]propanamide?
(2R)-2-amino-N-[2-(2-phenylethyl)pyrazol-3-yl]propanamide has a molecular weight of 258.33 g/mol, XLogP of 1.41, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[2-(2-phenylethyl)pyrazol-3-yl]propanamide is sourced from PubChem (CID 119282442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).