2-[(1,3-dimethylpyrazol-4-yl)methylamino]-2-methylpropanamide

C10H18N4O — CID 83089472

IUPAC2-[(1,3-dimethylpyrazol-4-yl)methylamino]-2-methylpropanamide
SMILESCc1nn(C)cc1CNC(C)(C)C(N)=O
InChIInChI=1S/C10H18N4O/c1-7-8(6-14(4)13-7)5-12-10(2,3)9(11)15/h6,12H,5H2,1-4H3,(H2,11,15)
InChIKeyJIJCXWHVDCJONK-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.08
Rot. Bonds4

About 2-[(1,3-dimethylpyrazol-4-yl)methylamino]-2-methylpropanamide

2-[(1,3-dimethylpyrazol-4-yl)methylamino]-2-methylpropanamide (PubChem CID 83089472) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 2-[(1,3-dimethylpyrazol-4-yl)methylamino]-2-methylpropanamide.

Molecular Properties

Compound Name2-[(1,3-dimethylpyrazol-4-yl)methylamino]-2-methylpropanamide
PubChem CID83089472
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name2-[(1,3-dimethylpyrazol-4-yl)methylamino]-2-methylpropanamide
SMILESCc1nn(C)cc1CNC(C)(C)C(N)=O
InChIInChI=1S/C10H18N4O/c1-7-8(6-14(4)13-7)5-12-10(2,3)9(11)15/h6,12H,5H2,1-4H3,(H2,11,15)
InChIKeyJIJCXWHVDCJONK-UHFFFAOYSA-N
XLogP0.08
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(1,3-dimethylpyrazol-4-yl)methylamino]-2,3-dimethylbutanamide
CID 112738020
N-[(1,3-dimethylpyrazol-4-yl)methyl]acetamide;ethane
CID 142558548
tert-butyl N-[2-[(1,3-dimethylpyrazol-4-yl)methylamino]-2-methylpropyl]carbamate
CID 103851547
2-[(1,3-dimethylpyrazol-4-yl)methylamino]-2-methylpentan-1-ol
CID 109482003
3-amino-N-[(1,3-dimethylpyrazol-4-yl)methyl]-3-hydroxyimino-2-methylpropanamide
CID 113358295
1-[(1,3-dimethylpyrazol-4-yl)methyl]-2-methylguanidine
CID 112670222
2-[(1,3-dimethylpyrazol-4-yl)methylamino]-N-(2-methylbutan-2-yl)propanamide
CID 112668993
ethyl 2-[(1,3-dimethylpyrazol-4-yl)methylamino]acetate
CID 83088889
2-chloro-5-[(1,3-dimethylpyrazol-4-yl)methylamino]benzamide
CID 83086550
N-[(1,3-dimethylpyrazol-4-yl)methyl]-2,2-dimethylpentan-3-amine
CID 115767853
5-amino-2-[(1,3-dimethylpyrazol-4-yl)methylamino]pyridine-3-carboxamide
CID 112668337
5-amino-6-[(1,3-dimethylpyrazol-4-yl)methylamino]pyridine-3-carboxylic acid
CID 112671919

Frequently Asked Questions

What is the IUPAC name of 2-[(1,3-dimethylpyrazol-4-yl)methylamino]-2-methylpropanamide?
The IUPAC name of 2-[(1,3-dimethylpyrazol-4-yl)methylamino]-2-methylpropanamide (CID 83089472) is 2-[(1,3-dimethylpyrazol-4-yl)methylamino]-2-methylpropanamide.
What is the SMILES notation for 2-[(1,3-dimethylpyrazol-4-yl)methylamino]-2-methylpropanamide?
The canonical SMILES for 2-[(1,3-dimethylpyrazol-4-yl)methylamino]-2-methylpropanamide is Cc1nn(C)cc1CNC(C)(C)C(N)=O.
What is the InChIKey of 2-[(1,3-dimethylpyrazol-4-yl)methylamino]-2-methylpropanamide?
The InChIKey is JIJCXWHVDCJONK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-7-8(6-14(4)13-7)5-12-10(2,3)9(11)15/h6,12H,5H2,1-4H3,(H2,11,15).
What are the key properties of 2-[(1,3-dimethylpyrazol-4-yl)methylamino]-2-methylpropanamide?
2-[(1,3-dimethylpyrazol-4-yl)methylamino]-2-methylpropanamide has a molecular weight of 210.28 g/mol, XLogP of 0.08, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1,3-dimethylpyrazol-4-yl)methylamino]-2-methylpropanamide is sourced from PubChem (CID 83089472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).