(2R)-2-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]propanamide;hydrochloride

C9H17ClN4O2 — CID 119292252

IUPAC(2R)-2-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]propanamide;hydrochloride
SMILESCOCCn1cc(NC(=O)[C@@H](C)N)cn1.Cl
InChIInChI=1S/C9H16N4O2.ClH/c1-7(10)9(14)12-8-5-11-13(6-8)3-4-15-2;/h5-7H,3-4,10H2,1-2H3,(H,12,14);1H/t7-;/m1./s1
InChIKeyQTYWCZSGFTXCHP-OGFXRTJISA-N
MW248.71 g/mol
LogP0.24
Rot. Bonds5

About (2R)-2-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]propanamide;hydrochloride

(2R)-2-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]propanamide;hydrochloride (PubChem CID 119292252) has the molecular formula C9H17ClN4O2 and a molecular weight of 248.71 g/mol. Its IUPAC name is (2R)-2-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]propanamide;hydrochloride.

Molecular Properties

Compound Name(2R)-2-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]propanamide;hydrochloride
PubChem CID119292252
Molecular FormulaC9H17ClN4O2
Molecular Weight248.71 g/mol
Exact Mass248.10
IUPAC Name(2R)-2-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]propanamide;hydrochloride
SMILESCOCCn1cc(NC(=O)[C@@H](C)N)cn1.Cl
InChIInChI=1S/C9H16N4O2.ClH/c1-7(10)9(14)12-8-5-11-13(6-8)3-4-15-2;/h5-7H,3-4,10H2,1-2H3,(H,12,14);1H/t7-;/m1./s1
InChIKeyQTYWCZSGFTXCHP-OGFXRTJISA-N
XLogP0.24
TPSA82.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.71
LogP ≤ 50.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze (2R)-2-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]propanamide;hydrochloride with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]propanamide;hydrochloride?
The IUPAC name of (2R)-2-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]propanamide;hydrochloride (CID 119292252) is (2R)-2-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]propanamide;hydrochloride.
What is the SMILES notation for (2R)-2-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]propanamide;hydrochloride?
The canonical SMILES for (2R)-2-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]propanamide;hydrochloride is COCCn1cc(NC(=O)[C@@H](C)N)cn1.Cl.
What is the InChIKey of (2R)-2-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]propanamide;hydrochloride?
The InChIKey is QTYWCZSGFTXCHP-OGFXRTJISA-N. The full InChI is InChI=1S/C9H16N4O2.ClH/c1-7(10)9(14)12-8-5-11-13(6-8)3-4-15-2;/h5-7H,3-4,10H2,1-2H3,(H,12,14);1H/t7-;/m1./s1.
What are the key properties of (2R)-2-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]propanamide;hydrochloride?
(2R)-2-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]propanamide;hydrochloride has a molecular weight of 248.71 g/mol, XLogP of 0.24, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]propanamide;hydrochloride is sourced from PubChem (CID 119292252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).