N-(2-amino-2-cyclopropylethyl)-1,3-dimethylpyrazole-4-carboxamide

C11H18N4O — CID 103872684

IUPACN-(2-amino-2-cyclopropylethyl)-1,3-dimethylpyrazole-4-carboxamide
SMILESCc1nn(C)cc1C(=O)NCC(N)C1CC1
InChIInChI=1S/C11H18N4O/c1-7-9(6-15(2)14-7)11(16)13-5-10(12)8-3-4-8/h6,8,10H,3-5,12H2,1-2H3,(H,13,16)
InChIKeyIBUUZCVHKULNQG-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.20
Rot. Bonds4

About N-(2-amino-2-cyclopropylethyl)-1,3-dimethylpyrazole-4-carboxamide

N-(2-amino-2-cyclopropylethyl)-1,3-dimethylpyrazole-4-carboxamide (PubChem CID 103872684) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is N-(2-amino-2-cyclopropylethyl)-1,3-dimethylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-cyclopropylethyl)-1,3-dimethylpyrazole-4-carboxamide
PubChem CID103872684
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC NameN-(2-amino-2-cyclopropylethyl)-1,3-dimethylpyrazole-4-carboxamide
SMILESCc1nn(C)cc1C(=O)NCC(N)C1CC1
InChIInChI=1S/C11H18N4O/c1-7-9(6-15(2)14-7)11(16)13-5-10(12)8-3-4-8/h6,8,10H,3-5,12H2,1-2H3,(H,13,16)
InChIKeyIBUUZCVHKULNQG-UHFFFAOYSA-N
XLogP0.20
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(2-amino-2-cyclopropylethyl)-1,3-dimethylpyrazole-4-carboxamide 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-(2-amino-3-ethylpentyl)-1,3-dimethylpyrazole-4-carboxamide
CID 114168450
(2S)-3-[(1,3-dimethylpyrazole-4-carbonyl)amino]-2-hydroxypropanoic acid
CID 107833607
2-[[(1,3-dimethylpyrazole-4-carbonyl)amino]methyl]-3-methylbutanoic acid
CID 102801287
N-(3-amino-3-hydroxyimino-2-methylpropyl)-1,3-dimethylpyrazole-4-carboxamide
CID 102802153
1,3-dimethyl-N-(piperidin-4-ylmethyl)pyrazole-4-carboxamide
CID 103805401
N-(2-amino-2-cyclopropylethyl)-2-hydroxy-5-methylbenzamide
CID 55242936
3-[[(1,3-dimethylpyrazole-4-carbonyl)amino]methyl]pentanoic acid
CID 102801321
N-(2-amino-2-cyclopropylethyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide
CID 115301105
N-(2-amino-2-cyclopropylethyl)-4-bromo-2-methylbenzamide
CID 113282155
N-(2-amino-2-cyclopropylethyl)-5-methoxy-1-methylpyrazole-3-carboxamide
CID 114255131
N-[(1R,2R)-2-hydroxycyclohexyl]-1,3-dimethylpyrazole-4-carboxamide
CID 104927400
N-(2-amino-2-cyclopropylethyl)-2-chlorofuran-3-carboxamide
CID 106688585

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-cyclopropylethyl)-1,3-dimethylpyrazole-4-carboxamide?
The IUPAC name of N-(2-amino-2-cyclopropylethyl)-1,3-dimethylpyrazole-4-carboxamide (CID 103872684) is N-(2-amino-2-cyclopropylethyl)-1,3-dimethylpyrazole-4-carboxamide.
What is the SMILES notation for N-(2-amino-2-cyclopropylethyl)-1,3-dimethylpyrazole-4-carboxamide?
The canonical SMILES for N-(2-amino-2-cyclopropylethyl)-1,3-dimethylpyrazole-4-carboxamide is Cc1nn(C)cc1C(=O)NCC(N)C1CC1.
What is the InChIKey of N-(2-amino-2-cyclopropylethyl)-1,3-dimethylpyrazole-4-carboxamide?
The InChIKey is IBUUZCVHKULNQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-7-9(6-15(2)14-7)11(16)13-5-10(12)8-3-4-8/h6,8,10H,3-5,12H2,1-2H3,(H,13,16).
What are the key properties of N-(2-amino-2-cyclopropylethyl)-1,3-dimethylpyrazole-4-carboxamide?
N-(2-amino-2-cyclopropylethyl)-1,3-dimethylpyrazole-4-carboxamide has a molecular weight of 222.29 g/mol, XLogP of 0.20, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-cyclopropylethyl)-1,3-dimethylpyrazole-4-carboxamide is sourced from PubChem (CID 103872684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).