N-[1-(2-ethylimidazol-1-yl)propan-2-yl]-2-(1-methylpyrazol-4-yl)piperidine-1-carboxamide

C18H28N6O — CID 167816630

IUPACN-[1-(2-ethylimidazol-1-yl)propan-2-yl]-2-(1-methylpyrazol-4-yl)piperidine-1-carboxamide
SMILESCCc1nccn1CC(C)NC(=O)N1CCCCC1c1cnn(C)c1
InChIInChI=1S/C18H28N6O/c1-4-17-19-8-10-23(17)12-14(2)21-18(25)24-9-6-5-7-16(24)15-11-20-22(3)13-15/h8,10-11,13-14,16H,4-7,9,12H2,1-3H3,(H,21,25)
InChIKeyYJSVVSREWRHBTD-UHFFFAOYSA-N
MW344.46 g/mol
LogP2.50
Rot. Bonds5

About N-[1-(2-ethylimidazol-1-yl)propan-2-yl]-2-(1-methylpyrazol-4-yl)piperidine-1-carboxamide

N-[1-(2-ethylimidazol-1-yl)propan-2-yl]-2-(1-methylpyrazol-4-yl)piperidine-1-carboxamide (PubChem CID 167816630) has the molecular formula C18H28N6O and a molecular weight of 344.46 g/mol. Its IUPAC name is N-[1-(2-ethylimidazol-1-yl)propan-2-yl]-2-(1-methylpyrazol-4-yl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-[1-(2-ethylimidazol-1-yl)propan-2-yl]-2-(1-methylpyrazol-4-yl)piperidine-1-carboxamide
PubChem CID167816630
Molecular FormulaC18H28N6O
Molecular Weight344.46 g/mol
Exact Mass344.23
IUPAC NameN-[1-(2-ethylimidazol-1-yl)propan-2-yl]-2-(1-methylpyrazol-4-yl)piperidine-1-carboxamide
SMILESCCc1nccn1CC(C)NC(=O)N1CCCCC1c1cnn(C)c1
InChIInChI=1S/C18H28N6O/c1-4-17-19-8-10-23(17)12-14(2)21-18(25)24-9-6-5-7-16(24)15-11-20-22(3)13-15/h8,10-11,13-14,16H,4-7,9,12H2,1-3H3,(H,21,25)
InChIKeyYJSVVSREWRHBTD-UHFFFAOYSA-N
XLogP2.50
TPSA67.98 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.46
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[1-(2-ethylimidazol-1-yl)propan-2-yl]-2-(1-methylpyrazol-4-yl)piperidine-1-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

(2R)-N-[(2S)-4-(5-methylfuran-2-yl)butan-2-yl]-2-(1-methylpyrazol-4-yl)pyrrolidine-1-carboxamide
CID 124883497
cyclohexyl-[(2R)-2-(1-methylpyrazol-4-yl)azepan-1-yl]methanone
CID 92566960
2-methyl-1-[2-(1-methylpyrazol-4-yl)pyrrolidin-1-yl]-3-pyrazol-1-ylpropan-1-one
CID 56824974
(2R)-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]-2-pyridin-4-ylpyrrolidine-1-carboxamide
CID 94031024
N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-2-(1-methylpyrazol-4-yl)piperidine-1-carboxamide
CID 167943119
2,2-dimethyl-1-[(2R)-2-(1-methylpyrazol-4-yl)azepan-1-yl]propan-1-one
CID 92551768
(2S)-1-[(2S)-2-(azepan-1-ylmethyl)piperidin-1-yl]-3-(2-ethylimidazol-1-yl)-2-methylpropan-1-one
CID 92589468
(2S)-2-(4-methoxyphenyl)-N-[(2S)-1-pyrazol-1-ylpropan-2-yl]pyrrolidine-1-carboxamide
CID 94102282
2-[(2S)-1-acetylpiperidin-2-yl]-1-[(2S)-2-(1-methylpyrazol-4-yl)pyrrolidin-1-yl]ethanone
CID 95348858
ethyl 2-[3-[[2-(1-methylpyrazol-4-yl)piperidine-1-carbonyl]amino]pyrazol-1-yl]acetate
CID 167922821
1-cyclopentyl-2-(2-ethylimidazol-1-yl)ethanone
CID 115769665
3-(2-ethylimidazol-1-yl)-1-[2-[2-(methylamino)-4-pyridinyl]pyrrolidin-1-yl]propan-1-one
CID 110105596

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-ethylimidazol-1-yl)propan-2-yl]-2-(1-methylpyrazol-4-yl)piperidine-1-carboxamide?
The IUPAC name of N-[1-(2-ethylimidazol-1-yl)propan-2-yl]-2-(1-methylpyrazol-4-yl)piperidine-1-carboxamide (CID 167816630) is N-[1-(2-ethylimidazol-1-yl)propan-2-yl]-2-(1-methylpyrazol-4-yl)piperidine-1-carboxamide.
What is the SMILES notation for N-[1-(2-ethylimidazol-1-yl)propan-2-yl]-2-(1-methylpyrazol-4-yl)piperidine-1-carboxamide?
The canonical SMILES for N-[1-(2-ethylimidazol-1-yl)propan-2-yl]-2-(1-methylpyrazol-4-yl)piperidine-1-carboxamide is CCc1nccn1CC(C)NC(=O)N1CCCCC1c1cnn(C)c1.
What is the InChIKey of N-[1-(2-ethylimidazol-1-yl)propan-2-yl]-2-(1-methylpyrazol-4-yl)piperidine-1-carboxamide?
The InChIKey is YJSVVSREWRHBTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N6O/c1-4-17-19-8-10-23(17)12-14(2)21-18(25)24-9-6-5-7-16(24)15-11-20-22(3)13-15/h8,10-11,13-14,16H,4-7,9,12H2,1-3H3,(H,21,25).
What are the key properties of N-[1-(2-ethylimidazol-1-yl)propan-2-yl]-2-(1-methylpyrazol-4-yl)piperidine-1-carboxamide?
N-[1-(2-ethylimidazol-1-yl)propan-2-yl]-2-(1-methylpyrazol-4-yl)piperidine-1-carboxamide has a molecular weight of 344.46 g/mol, XLogP of 2.50, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-ethylimidazol-1-yl)propan-2-yl]-2-(1-methylpyrazol-4-yl)piperidine-1-carboxamide is sourced from PubChem (CID 167816630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).