N-[(4-ethyl-1-hydroxycyclohexyl)methyl]-1-methylpyrazole-4-carboxamide

C14H23N3O2 — CID 65123731

IUPACN-[(4-ethyl-1-hydroxycyclohexyl)methyl]-1-methylpyrazole-4-carboxamide
SMILESCCC1CCC(O)(CNC(=O)c2cnn(C)c2)CC1
InChIInChI=1S/C14H23N3O2/c1-3-11-4-6-14(19,7-5-11)10-15-13(18)12-8-16-17(2)9-12/h8-9,11,19H,3-7,10H2,1-2H3,(H,15,18)
InChIKeyNNFGHJDZNGCZRT-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.48
Rot. Bonds4

About N-[(4-ethyl-1-hydroxycyclohexyl)methyl]-1-methylpyrazole-4-carboxamide

N-[(4-ethyl-1-hydroxycyclohexyl)methyl]-1-methylpyrazole-4-carboxamide (PubChem CID 65123731) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is N-[(4-ethyl-1-hydroxycyclohexyl)methyl]-1-methylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-[(4-ethyl-1-hydroxycyclohexyl)methyl]-1-methylpyrazole-4-carboxamide
PubChem CID65123731
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC NameN-[(4-ethyl-1-hydroxycyclohexyl)methyl]-1-methylpyrazole-4-carboxamide
SMILESCCC1CCC(O)(CNC(=O)c2cnn(C)c2)CC1
InChIInChI=1S/C14H23N3O2/c1-3-11-4-6-14(19,7-5-11)10-15-13(18)12-8-16-17(2)9-12/h8-9,11,19H,3-7,10H2,1-2H3,(H,15,18)
InChIKeyNNFGHJDZNGCZRT-UHFFFAOYSA-N
XLogP1.48
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[(4-ethyl-1-hydroxycyclohexyl)methyl]-1-methylpyrazole-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

1-methyl-N-[(1-propoxycyclohexyl)methyl]pyrazole-4-carboxamide
CID 71979184
1-ethyl-N-[(1-hydroxycyclobutyl)methyl]pyrazole-4-carboxamide
CID 71984108
N-[(1-methoxycyclohexyl)methyl]-1-(2,2,2-trifluoroethyl)pyrazole-4-carboxamide
CID 119044752
N-[[(1S,3R)-3-(hydroxymethyl)cyclohexyl]methyl]-1-(2-methylpropyl)pyrazole-4-carboxamide
CID 126813204
N-[[(1S)-1-hydroxy-2,2-dimethylcyclopentyl]methyl]-1-propylpyrazole-4-carboxamide
CID 164632785
1-cyclopropyl-N-[[4-(difluoromethyl)-1-methoxycyclohexyl]methyl]pyrazole-4-carboxamide
CID 137880430
N-[2,2-difluoro-2-(1-hydroxycyclohexyl)ethyl]-1-methylpyrazole-4-carboxamide
CID 138022380
N-(2-hydroxyethyl)-1-(6-hydroxyhexyl)pyrazole-4-carboxamide
CID 166457088
1-(4-Hydroxy-4-methylcyclohexyl)pyrazole-4-carboxamide
CID 175719624
4-[[(2-Methylcyclohexyl)amino]carbonyl]-1H-pyrazole-1-acetic acid
CID 19621953
2-[4-[(4-Methylcyclohexyl)carbamoyl]pyrazol-1-yl]acetic acid
CID 19621957
2-[4-[(2-Methylcyclohexyl)carbamoyl]pyrazol-1-yl]propanoic acid
CID 19622071

Frequently Asked Questions

What is the IUPAC name of N-[(4-ethyl-1-hydroxycyclohexyl)methyl]-1-methylpyrazole-4-carboxamide?
The IUPAC name of N-[(4-ethyl-1-hydroxycyclohexyl)methyl]-1-methylpyrazole-4-carboxamide (CID 65123731) is N-[(4-ethyl-1-hydroxycyclohexyl)methyl]-1-methylpyrazole-4-carboxamide.
What is the SMILES notation for N-[(4-ethyl-1-hydroxycyclohexyl)methyl]-1-methylpyrazole-4-carboxamide?
The canonical SMILES for N-[(4-ethyl-1-hydroxycyclohexyl)methyl]-1-methylpyrazole-4-carboxamide is CCC1CCC(O)(CNC(=O)c2cnn(C)c2)CC1.
What is the InChIKey of N-[(4-ethyl-1-hydroxycyclohexyl)methyl]-1-methylpyrazole-4-carboxamide?
The InChIKey is NNFGHJDZNGCZRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-3-11-4-6-14(19,7-5-11)10-15-13(18)12-8-16-17(2)9-12/h8-9,11,19H,3-7,10H2,1-2H3,(H,15,18).
What are the key properties of N-[(4-ethyl-1-hydroxycyclohexyl)methyl]-1-methylpyrazole-4-carboxamide?
N-[(4-ethyl-1-hydroxycyclohexyl)methyl]-1-methylpyrazole-4-carboxamide has a molecular weight of 265.36 g/mol, XLogP of 1.48, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethyl-1-hydroxycyclohexyl)methyl]-1-methylpyrazole-4-carboxamide is sourced from PubChem (CID 65123731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).