2-amino-N-(5-propan-2-yl-1H-pyrazol-3-yl)propanamide

C9H16N4O — CID 115976344

IUPAC2-amino-N-(5-propan-2-yl-1H-pyrazol-3-yl)propanamide
SMILESCC(N)C(=O)Nc1cc(C(C)C)[nH]n1
InChIInChI=1S/C9H16N4O/c1-5(2)7-4-8(13-12-7)11-9(14)6(3)10/h4-6H,10H2,1-3H3,(H2,11,12,13,14)
InChIKeyGGTJEYNTNYDALT-UHFFFAOYSA-N
MW196.25 g/mol
LogP0.82
Rot. Bonds3

About 2-amino-N-(5-propan-2-yl-1H-pyrazol-3-yl)propanamide

2-amino-N-(5-propan-2-yl-1H-pyrazol-3-yl)propanamide (PubChem CID 115976344) has the molecular formula C9H16N4O and a molecular weight of 196.25 g/mol. Its IUPAC name is 2-amino-N-(5-propan-2-yl-1H-pyrazol-3-yl)propanamide.

Molecular Properties

Compound Name2-amino-N-(5-propan-2-yl-1H-pyrazol-3-yl)propanamide
PubChem CID115976344
Molecular FormulaC9H16N4O
Molecular Weight196.25 g/mol
Exact Mass196.13
IUPAC Name2-amino-N-(5-propan-2-yl-1H-pyrazol-3-yl)propanamide
SMILESCC(N)C(=O)Nc1cc(C(C)C)[nH]n1
InChIInChI=1S/C9H16N4O/c1-5(2)7-4-8(13-12-7)11-9(14)6(3)10/h4-6H,10H2,1-3H3,(H2,11,12,13,14)
InChIKeyGGTJEYNTNYDALT-UHFFFAOYSA-N
XLogP0.82
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(5-propan-2-yl-1H-pyrazol-3-yl)butanamide
CID 115976338
2-amino-4-methyl-N-(5-propan-2-yl-1H-pyrazol-3-yl)pentanamide
CID 112639598
3-amino-N-(5-propan-2-yl-1H-pyrazol-3-yl)butanamide
CID 104618436
4-amino-2-methyl-N-(5-propan-2-yl-1H-pyrazol-3-yl)butanamide
CID 104618326
2-amino-N-(5-propan-2-yl-1H-pyrazol-3-yl)-2-thiophen-2-ylacetamide
CID 104618474
3-amino-N-(5-propan-2-yl-1H-pyrazol-3-yl)pentanamide
CID 104618403
N-(5-propan-2-yl-1H-pyrazol-3-yl)benzamide
CID 47404990
N-(5-propan-2-yl-1H-pyrazol-3-yl)cyclooctanecarboxamide
CID 115663305
4-amino-4-methyl-N-(5-propan-2-yl-1H-pyrazol-3-yl)pentanamide
CID 104618390
4-methyl-N-(5-propan-2-yl-1H-pyrazol-3-yl)benzamide
CID 47404997
5-chloro-N-(5-propan-2-yl-1H-pyrazol-3-yl)pentanamide
CID 104617733
6-oxo-6-[(5-propan-2-yl-1H-pyrazol-3-yl)amino]hexanoic acid
CID 104617331

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(5-propan-2-yl-1H-pyrazol-3-yl)propanamide?
The IUPAC name of 2-amino-N-(5-propan-2-yl-1H-pyrazol-3-yl)propanamide (CID 115976344) is 2-amino-N-(5-propan-2-yl-1H-pyrazol-3-yl)propanamide.
What is the SMILES notation for 2-amino-N-(5-propan-2-yl-1H-pyrazol-3-yl)propanamide?
The canonical SMILES for 2-amino-N-(5-propan-2-yl-1H-pyrazol-3-yl)propanamide is CC(N)C(=O)Nc1cc(C(C)C)[nH]n1.
What is the InChIKey of 2-amino-N-(5-propan-2-yl-1H-pyrazol-3-yl)propanamide?
The InChIKey is GGTJEYNTNYDALT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4O/c1-5(2)7-4-8(13-12-7)11-9(14)6(3)10/h4-6H,10H2,1-3H3,(H2,11,12,13,14).
What are the key properties of 2-amino-N-(5-propan-2-yl-1H-pyrazol-3-yl)propanamide?
2-amino-N-(5-propan-2-yl-1H-pyrazol-3-yl)propanamide has a molecular weight of 196.25 g/mol, XLogP of 0.82, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(5-propan-2-yl-1H-pyrazol-3-yl)propanamide is sourced from PubChem (CID 115976344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).