5-amino-N-(4-ethylcyclohexyl)-N-methyl-1H-pyrazole-4-carboxamide

C13H22N4O — CID 54948229

IUPAC5-amino-N-(4-ethylcyclohexyl)-N-methyl-1H-pyrazole-4-carboxamide
SMILESCCC1CCC(N(C)C(=O)c2cn[nH]c2N)CC1
InChIInChI=1S/C13H22N4O/c1-3-9-4-6-10(7-5-9)17(2)13(18)11-8-15-16-12(11)14/h8-10H,3-7H2,1-2H3,(H3,14,15,16)
InChIKeyDXMOEMGRPSGENU-UHFFFAOYSA-N
MW250.35 g/mol
LogP2.03
Rot. Bonds3

About 5-amino-N-(4-ethylcyclohexyl)-N-methyl-1H-pyrazole-4-carboxamide

5-amino-N-(4-ethylcyclohexyl)-N-methyl-1H-pyrazole-4-carboxamide (PubChem CID 54948229) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is 5-amino-N-(4-ethylcyclohexyl)-N-methyl-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-amino-N-(4-ethylcyclohexyl)-N-methyl-1H-pyrazole-4-carboxamide
PubChem CID54948229
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC Name5-amino-N-(4-ethylcyclohexyl)-N-methyl-1H-pyrazole-4-carboxamide
SMILESCCC1CCC(N(C)C(=O)c2cn[nH]c2N)CC1
InChIInChI=1S/C13H22N4O/c1-3-9-4-6-10(7-5-9)17(2)13(18)11-8-15-16-12(11)14/h8-10H,3-7H2,1-2H3,(H3,14,15,16)
InChIKeyDXMOEMGRPSGENU-UHFFFAOYSA-N
XLogP2.03
TPSA75.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-amino-N-(4-ethylcyclohexyl)-N-methyl-1H-pyrazole-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

4-amino-N-(4-ethylcyclohexyl)-N-methyl-1H-pyrazole-5-carboxamide
CID 63104142
(5-amino-1H-pyrazol-4-yl)-(4-ethylpiperidin-1-yl)methanone
CID 61421520
4-amino-5-cyclopropyl-N-(4-ethylcyclohexyl)-N-methyl-1H-pyrazole-3-carboxamide
CID 62079532
5-amino-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]-1H-pyrazole-4-carboxamide
CID 63235520
N-(4-ethylcyclohexyl)-N-methyl-4-(methylamino)pyridine-3-carboxamide
CID 81240350
4-amino-1-ethyl-N-(4-ethylcyclohexyl)-N-methylpyrazole-5-carboxamide
CID 65358607
5-amino-N,N-dipropyl-1H-pyrazole-4-carboxamide
CID 43159428
5-amino-N-butyl-N-methyl-1H-pyrazole-4-carboxamide
CID 43159518
5-amino-N-[(1-hydroxycyclopentyl)methyl]-N-methyl-1H-pyrazole-4-carboxamide
CID 114951112
1-(4-ethylcyclohexyl)-1-methylurea
CID 61449062
2-bromo-N-(4-ethylcyclohexyl)-N-methyl-5-sulfanylbenzamide
CID 107024800
5-bromo-N-(4-ethylcyclohexyl)-N-methylthiophene-3-carboxamide
CID 60738324

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(4-ethylcyclohexyl)-N-methyl-1H-pyrazole-4-carboxamide?
The IUPAC name of 5-amino-N-(4-ethylcyclohexyl)-N-methyl-1H-pyrazole-4-carboxamide (CID 54948229) is 5-amino-N-(4-ethylcyclohexyl)-N-methyl-1H-pyrazole-4-carboxamide.
What is the SMILES notation for 5-amino-N-(4-ethylcyclohexyl)-N-methyl-1H-pyrazole-4-carboxamide?
The canonical SMILES for 5-amino-N-(4-ethylcyclohexyl)-N-methyl-1H-pyrazole-4-carboxamide is CCC1CCC(N(C)C(=O)c2cn[nH]c2N)CC1.
What is the InChIKey of 5-amino-N-(4-ethylcyclohexyl)-N-methyl-1H-pyrazole-4-carboxamide?
The InChIKey is DXMOEMGRPSGENU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-3-9-4-6-10(7-5-9)17(2)13(18)11-8-15-16-12(11)14/h8-10H,3-7H2,1-2H3,(H3,14,15,16).
What are the key properties of 5-amino-N-(4-ethylcyclohexyl)-N-methyl-1H-pyrazole-4-carboxamide?
5-amino-N-(4-ethylcyclohexyl)-N-methyl-1H-pyrazole-4-carboxamide has a molecular weight of 250.35 g/mol, XLogP of 2.03, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(4-ethylcyclohexyl)-N-methyl-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 54948229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).