2-(3-aminopyrazol-1-yl)-N-propan-2-ylpropanamide

C9H16N4O — CID 60783024

IUPAC2-(3-aminopyrazol-1-yl)-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)C(C)n1ccc(N)n1
InChIInChI=1S/C9H16N4O/c1-6(2)11-9(14)7(3)13-5-4-8(10)12-13/h4-7H,1-3H3,(H2,10,12)(H,11,14)
InChIKeyWQYUMHXKIVASTF-UHFFFAOYSA-N
MW196.25 g/mol
LogP0.55
Rot. Bonds3

About 2-(3-aminopyrazol-1-yl)-N-propan-2-ylpropanamide

2-(3-aminopyrazol-1-yl)-N-propan-2-ylpropanamide (PubChem CID 60783024) has the molecular formula C9H16N4O and a molecular weight of 196.25 g/mol. Its IUPAC name is 2-(3-aminopyrazol-1-yl)-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name2-(3-aminopyrazol-1-yl)-N-propan-2-ylpropanamide
PubChem CID60783024
Molecular FormulaC9H16N4O
Molecular Weight196.25 g/mol
Exact Mass196.13
IUPAC Name2-(3-aminopyrazol-1-yl)-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)C(C)n1ccc(N)n1
InChIInChI=1S/C9H16N4O/c1-6(2)11-9(14)7(3)13-5-4-8(10)12-13/h4-7H,1-3H3,(H2,10,12)(H,11,14)
InChIKeyWQYUMHXKIVASTF-UHFFFAOYSA-N
XLogP0.55
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-aminopyrazol-1-yl)-N-(3-methoxypropyl)propanamide
CID 60783044
4-amino-1-[1-oxo-1-(propan-2-ylamino)propan-2-yl]pyrazole-3-carboxamide
CID 107345162
2-(3-cyclopropylpyrazol-1-yl)propanehydrazide
CID 19621368
2-(4-bromo-3-methylpyrazol-1-yl)-N-propan-2-ylpropanamide
CID 17020886
2-(3-bromopyrazol-1-yl)-N-carbamoylpropanamide
CID 130763298
(2S)-2-(4-bromopyrazol-1-yl)-N-propan-2-ylpropanamide
CID 35522913
4-(3-aminopyrazol-1-yl)-N-propan-2-ylpiperidine-1-carboxamide
CID 107109443
[2-oxo-2-(propan-2-ylamino)ethyl] 2-(3-aminopyrazol-1-yl)acetate
CID 55035689
2-(3-methylindazol-1-yl)-N-propan-2-ylpropanamide
CID 22509793
N-cyclopentyl-2-(3-methylpyrazol-1-yl)propanamide
CID 19534188
(2R)-2-(3-aminopyrazol-1-yl)pentanoic acid
CID 124669645
2-(4-bromo-3-nitropyrazol-1-yl)-N-propan-2-ylpropanamide
CID 61192856

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminopyrazol-1-yl)-N-propan-2-ylpropanamide?
The IUPAC name of 2-(3-aminopyrazol-1-yl)-N-propan-2-ylpropanamide (CID 60783024) is 2-(3-aminopyrazol-1-yl)-N-propan-2-ylpropanamide.
What is the SMILES notation for 2-(3-aminopyrazol-1-yl)-N-propan-2-ylpropanamide?
The canonical SMILES for 2-(3-aminopyrazol-1-yl)-N-propan-2-ylpropanamide is CC(C)NC(=O)C(C)n1ccc(N)n1.
What is the InChIKey of 2-(3-aminopyrazol-1-yl)-N-propan-2-ylpropanamide?
The InChIKey is WQYUMHXKIVASTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4O/c1-6(2)11-9(14)7(3)13-5-4-8(10)12-13/h4-7H,1-3H3,(H2,10,12)(H,11,14).
What are the key properties of 2-(3-aminopyrazol-1-yl)-N-propan-2-ylpropanamide?
2-(3-aminopyrazol-1-yl)-N-propan-2-ylpropanamide has a molecular weight of 196.25 g/mol, XLogP of 0.55, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminopyrazol-1-yl)-N-propan-2-ylpropanamide is sourced from PubChem (CID 60783024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).