(2R)-2-amino-N-methyl-N-(1-methylpyrazol-4-yl)propanamide;hydrochloride

C8H15ClN4O — CID 130617270

IUPAC(2R)-2-amino-N-methyl-N-(1-methylpyrazol-4-yl)propanamide;hydrochloride
SMILESC[C@@H](N)C(=O)N(C)c1cnn(C)c1.Cl
InChIInChI=1S/C8H14N4O.ClH/c1-6(9)8(13)12(3)7-4-10-11(2)5-7;/h4-6H,9H2,1-3H3;1H/t6-;/m1./s1
InChIKeyRRULHBWCRKQDRT-FYZOBXCZSA-N
MW218.69 g/mol
LogP0.15
Rot. Bonds2

About (2R)-2-amino-N-methyl-N-(1-methylpyrazol-4-yl)propanamide;hydrochloride

(2R)-2-amino-N-methyl-N-(1-methylpyrazol-4-yl)propanamide;hydrochloride (PubChem CID 130617270) has the molecular formula C8H15ClN4O and a molecular weight of 218.69 g/mol. Its IUPAC name is (2R)-2-amino-N-methyl-N-(1-methylpyrazol-4-yl)propanamide;hydrochloride.

Molecular Properties

Compound Name(2R)-2-amino-N-methyl-N-(1-methylpyrazol-4-yl)propanamide;hydrochloride
PubChem CID130617270
Molecular FormulaC8H15ClN4O
Molecular Weight218.69 g/mol
Exact Mass218.09
IUPAC Name(2R)-2-amino-N-methyl-N-(1-methylpyrazol-4-yl)propanamide;hydrochloride
SMILESC[C@@H](N)C(=O)N(C)c1cnn(C)c1.Cl
InChIInChI=1S/C8H14N4O.ClH/c1-6(9)8(13)12(3)7-4-10-11(2)5-7;/h4-6H,9H2,1-3H3;1H/t6-;/m1./s1
InChIKeyRRULHBWCRKQDRT-FYZOBXCZSA-N
XLogP0.15
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.69
LogP ≤ 50.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-1-(1-methylpyrazol-4-yl)propan-1-one
CID 82595197
N-methyl-N-(1-methylpyrazol-4-yl)-2-[3-(trifluoromethyl)pyrazol-1-yl]propanamide
CID 155953451
2-amino-N,3-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]butanamide;dihydrochloride
CID 119834029
2-amino-N-(4-hydroxyphenyl)-N-methylpropanamide
CID 23221170
N,1-dimethyl-N-propan-2-ylpyrazole-4-carboxamide
CID 131067296
2-[methyl-(1-methylpyrazol-4-yl)amino]acetic acid
CID 82538136
(2R)-2-amino-N-methyl-N-(4-methylsulfanylphenyl)propanamide;hydrochloride
CID 119320848
N-methyl-N-(1-methylpyrazol-4-yl)-3-piperidin-3-ylbutanamide;dihydrochloride
CID 119893068
N-methyl-N-(1-methylpyrazol-4-yl)piperidine-3-carboxamide;dihydrochloride
CID 119893048
N-methyl-N-(1-methylpyrazol-4-yl)pyrrolidine-2-carboxamide
CID 119893081
methyl 2-methyl-3-(1-methylpyrazol-4-yl)-3-oxopropanoate
CID 65198194
N,1-dimethyl-N-trimethylsilylpyrazol-4-amine
CID 140624297

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-methyl-N-(1-methylpyrazol-4-yl)propanamide;hydrochloride?
The IUPAC name of (2R)-2-amino-N-methyl-N-(1-methylpyrazol-4-yl)propanamide;hydrochloride (CID 130617270) is (2R)-2-amino-N-methyl-N-(1-methylpyrazol-4-yl)propanamide;hydrochloride.
What is the SMILES notation for (2R)-2-amino-N-methyl-N-(1-methylpyrazol-4-yl)propanamide;hydrochloride?
The canonical SMILES for (2R)-2-amino-N-methyl-N-(1-methylpyrazol-4-yl)propanamide;hydrochloride is C[C@@H](N)C(=O)N(C)c1cnn(C)c1.Cl.
What is the InChIKey of (2R)-2-amino-N-methyl-N-(1-methylpyrazol-4-yl)propanamide;hydrochloride?
The InChIKey is RRULHBWCRKQDRT-FYZOBXCZSA-N. The full InChI is InChI=1S/C8H14N4O.ClH/c1-6(9)8(13)12(3)7-4-10-11(2)5-7;/h4-6H,9H2,1-3H3;1H/t6-;/m1./s1.
What are the key properties of (2R)-2-amino-N-methyl-N-(1-methylpyrazol-4-yl)propanamide;hydrochloride?
(2R)-2-amino-N-methyl-N-(1-methylpyrazol-4-yl)propanamide;hydrochloride has a molecular weight of 218.69 g/mol, XLogP of 0.15, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-methyl-N-(1-methylpyrazol-4-yl)propanamide;hydrochloride is sourced from PubChem (CID 130617270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).