(2R)-N-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)propanamide

C11H20N4O — CID 103952287

IUPAC(2R)-N-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)propanamide
SMILESCNC(=O)[C@@H](C)NC(C)CCn1cccn1
InChIInChI=1S/C11H20N4O/c1-9(14-10(2)11(16)12-3)5-8-15-7-4-6-13-15/h4,6-7,9-10,14H,5,8H2,1-3H3,(H,12,16)/t9?,10-/m1/s1
InChIKeyQJASLGPAVKFUGM-QVDQXJPCSA-N
MW224.31 g/mol
LogP0.39
Rot. Bonds6

About (2R)-N-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)propanamide

(2R)-N-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)propanamide (PubChem CID 103952287) has the molecular formula C11H20N4O and a molecular weight of 224.31 g/mol. Its IUPAC name is (2R)-N-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)propanamide.

Molecular Properties

Compound Name(2R)-N-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)propanamide
PubChem CID103952287
Molecular FormulaC11H20N4O
Molecular Weight224.31 g/mol
Exact Mass224.16
IUPAC Name(2R)-N-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)propanamide
SMILESCNC(=O)[C@@H](C)NC(C)CCn1cccn1
InChIInChI=1S/C11H20N4O/c1-9(14-10(2)11(16)12-3)5-8-15-7-4-6-13-15/h4,6-7,9-10,14H,5,8H2,1-3H3,(H,12,16)/t9?,10-/m1/s1
InChIKeyQJASLGPAVKFUGM-QVDQXJPCSA-N
XLogP0.39
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze (2R)-N-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)propanamide 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

N-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)acetamide
CID 115977436
(2S)-2-(4-pyrazol-1-ylbutan-2-ylamino)propan-1-ol
CID 103952125
N-but-3-en-2-yl-4-pyrazol-1-ylbutan-2-amine
CID 115977708
(2R)-1-(4-pyrazol-1-ylbutan-2-ylamino)propan-2-ol
CID 103952260
methyl 2-(propan-2-ylamino)-4-pyrazol-1-ylbutanoate
CID 63040313
ethyl 2-(propan-2-ylamino)-4-pyrazol-1-ylbutanoate
CID 55144911
N-(furan-2-ylmethyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)propanamide
CID 61462816
1-(2-methoxyethyl)-1-methyl-3-[(2R)-4-pyrazol-1-ylbutan-2-yl]urea
CID 126453238
1-methyl-3-(2-pyrazol-1-ylethyl)urea
CID 23548396
N-(4-pyrazol-1-ylbutan-2-yl)pentan-1-amine
CID 115976552
N-(2-methylsulfonylethyl)-4-pyrazol-1-ylbutan-2-amine
CID 115977569
2,2-dimethyl-3-(4-pyrazol-1-ylbutan-2-ylamino)propan-1-ol
CID 115977842

Frequently Asked Questions

What is the IUPAC name of (2R)-N-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)propanamide?
The IUPAC name of (2R)-N-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)propanamide (CID 103952287) is (2R)-N-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)propanamide.
What is the SMILES notation for (2R)-N-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)propanamide?
The canonical SMILES for (2R)-N-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)propanamide is CNC(=O)[C@@H](C)NC(C)CCn1cccn1.
What is the InChIKey of (2R)-N-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)propanamide?
The InChIKey is QJASLGPAVKFUGM-QVDQXJPCSA-N. The full InChI is InChI=1S/C11H20N4O/c1-9(14-10(2)11(16)12-3)5-8-15-7-4-6-13-15/h4,6-7,9-10,14H,5,8H2,1-3H3,(H,12,16)/t9?,10-/m1/s1.
What are the key properties of (2R)-N-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)propanamide?
(2R)-N-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)propanamide has a molecular weight of 224.31 g/mol, XLogP of 0.39, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)propanamide is sourced from PubChem (CID 103952287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).