2-amino-N-(1,3-dimethylpyrazol-4-yl)-3-methylbutanamide

C10H18N4O — CID 103796990

IUPAC2-amino-N-(1,3-dimethylpyrazol-4-yl)-3-methylbutanamide
SMILESCc1nn(C)cc1NC(=O)C(N)C(C)C
InChIInChI=1S/C10H18N4O/c1-6(2)9(11)10(15)12-8-5-14(4)13-7(8)3/h5-6,9H,11H2,1-4H3,(H,12,15)
InChIKeyWOGNCKZOYAEUHW-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.65
Rot. Bonds3

About 2-amino-N-(1,3-dimethylpyrazol-4-yl)-3-methylbutanamide

2-amino-N-(1,3-dimethylpyrazol-4-yl)-3-methylbutanamide (PubChem CID 103796990) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 2-amino-N-(1,3-dimethylpyrazol-4-yl)-3-methylbutanamide.

Molecular Properties

Compound Name2-amino-N-(1,3-dimethylpyrazol-4-yl)-3-methylbutanamide
PubChem CID103796990
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name2-amino-N-(1,3-dimethylpyrazol-4-yl)-3-methylbutanamide
SMILESCc1nn(C)cc1NC(=O)C(N)C(C)C
InChIInChI=1S/C10H18N4O/c1-6(2)9(11)10(15)12-8-5-14(4)13-7(8)3/h5-6,9H,11H2,1-4H3,(H,12,15)
InChIKeyWOGNCKZOYAEUHW-UHFFFAOYSA-N
XLogP0.65
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-(3-ethyl-1-methylpyrazol-4-yl)-3-methylbutanamide
CID 107463141
(2S)-2-amino-N-(1,3-dimethylpyrazol-4-yl)-4-methylpentanamide
CID 103811522
2-cyano-N-(1,3-dimethylpyrazol-4-yl)-3-methylbutanamide
CID 102805652
2-amino-N-(1,3-dimethylpyrazol-4-yl)-4-phenylbutanamide
CID 102805533
N-(1,3-dimethylpyrazol-4-yl)-2-hydrazinyl-2-oxoacetamide
CID 102806911
N-(1,3-dimethylpyrazol-4-yl)-2-(N'-hydroxycarbamimidoyl)butanamide
CID 102806891
1-(1,3-dimethylpyrazol-4-yl)-3-[4-(1-hydroxyethyl)phenyl]urea
CID 102807086
N-(1,3-dimethylpyrazol-4-yl)-2-sulfanylacetamide
CID 102807672
2-[(1,3-dimethylpyrazol-4-yl)amino]-N-propan-2-ylpropanamide
CID 102805494
(3S)-3-[[(1,3-dimethylpyrazol-4-yl)carbamoylamino]methyl]-5-methylhexanoic acid
CID 102806615
2-amino-N-[2-(2-hydroxyethyl)-5-methylpyrazol-3-yl]-3-methylbutanamide
CID 110481411
2-chloro-N-[(1,3-dimethylpyrazol-4-yl)carbamoyl]acetamide
CID 102806777

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1,3-dimethylpyrazol-4-yl)-3-methylbutanamide?
The IUPAC name of 2-amino-N-(1,3-dimethylpyrazol-4-yl)-3-methylbutanamide (CID 103796990) is 2-amino-N-(1,3-dimethylpyrazol-4-yl)-3-methylbutanamide.
What is the SMILES notation for 2-amino-N-(1,3-dimethylpyrazol-4-yl)-3-methylbutanamide?
The canonical SMILES for 2-amino-N-(1,3-dimethylpyrazol-4-yl)-3-methylbutanamide is Cc1nn(C)cc1NC(=O)C(N)C(C)C.
What is the InChIKey of 2-amino-N-(1,3-dimethylpyrazol-4-yl)-3-methylbutanamide?
The InChIKey is WOGNCKZOYAEUHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-6(2)9(11)10(15)12-8-5-14(4)13-7(8)3/h5-6,9H,11H2,1-4H3,(H,12,15).
What are the key properties of 2-amino-N-(1,3-dimethylpyrazol-4-yl)-3-methylbutanamide?
2-amino-N-(1,3-dimethylpyrazol-4-yl)-3-methylbutanamide has a molecular weight of 210.28 g/mol, XLogP of 0.65, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1,3-dimethylpyrazol-4-yl)-3-methylbutanamide is sourced from PubChem (CID 103796990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).