(2S)-2-(1H-imidazol-2-yl)-N-[1-[[(2S)-oxolan-2-yl]methyl]pyrazol-4-yl]piperidine-1-carboxamide

C17H24N6O2 — CID 97054254

IUPAC(2S)-2-(1H-imidazol-2-yl)-N-[1-[[(2S)-oxolan-2-yl]methyl]pyrazol-4-yl]piperidine-1-carboxamide
SMILESO=C(Nc1cnn(C[C@@H]2CCCO2)c1)N1CCCC[C@H]1c1ncc[nH]1
InChIInChI=1S/C17H24N6O2/c24-17(23-8-2-1-5-15(23)16-18-6-7-19-16)21-13-10-20-22(11-13)12-14-4-3-9-25-14/h6-7,10-11,14-15H,1-5,8-9,12H2,(H,18,19)(H,21,24)/t14-,15-/m0/s1
InChIKeyQGNPYAYCHNPFOW-GJZGRUSLSA-N
MW344.42 g/mol
LogP2.54
Rot. Bonds4

About (2S)-2-(1H-imidazol-2-yl)-N-[1-[[(2S)-oxolan-2-yl]methyl]pyrazol-4-yl]piperidine-1-carboxamide

(2S)-2-(1H-imidazol-2-yl)-N-[1-[[(2S)-oxolan-2-yl]methyl]pyrazol-4-yl]piperidine-1-carboxamide (PubChem CID 97054254) has the molecular formula C17H24N6O2 and a molecular weight of 344.42 g/mol. Its IUPAC name is (2S)-2-(1H-imidazol-2-yl)-N-[1-[[(2S)-oxolan-2-yl]methyl]pyrazol-4-yl]piperidine-1-carboxamide.

Molecular Properties

Compound Name(2S)-2-(1H-imidazol-2-yl)-N-[1-[[(2S)-oxolan-2-yl]methyl]pyrazol-4-yl]piperidine-1-carboxamide
PubChem CID97054254
Molecular FormulaC17H24N6O2
Molecular Weight344.42 g/mol
Exact Mass344.20
IUPAC Name(2S)-2-(1H-imidazol-2-yl)-N-[1-[[(2S)-oxolan-2-yl]methyl]pyrazol-4-yl]piperidine-1-carboxamide
SMILESO=C(Nc1cnn(C[C@@H]2CCCO2)c1)N1CCCC[C@H]1c1ncc[nH]1
InChIInChI=1S/C17H24N6O2/c24-17(23-8-2-1-5-15(23)16-18-6-7-19-16)21-13-10-20-22(11-13)12-14-4-3-9-25-14/h6-7,10-11,14-15H,1-5,8-9,12H2,(H,18,19)(H,21,24)/t14-,15-/m0/s1
InChIKeyQGNPYAYCHNPFOW-GJZGRUSLSA-N
XLogP2.54
TPSA88.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze (2S)-2-(1H-imidazol-2-yl)-N-[1-[[(2S)-oxolan-2-yl]methyl]pyrazol-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

4-methyl-N-[1-(oxan-2-ylmethyl)pyrazol-4-yl]piperazine-1-carboxamide
CID 121145358
2-(1H-imidazol-2-yl)-N-(1-pyridin-2-ylpyrazol-4-yl)piperidine-1-carboxamide
CID 86778865
(3S)-N-[1-[[(2S)-oxolan-2-yl]methyl]pyrazol-4-yl]-3-pyrrolidin-1-ylpyrrolidine-1-carboxamide
CID 96567739
N-[1-[[(2R)-oxolan-2-yl]methyl]pyrazol-4-yl]-8-azaspiro[4.5]decane-8-carboxamide
CID 95899494
N-[1-[[(2R)-oxan-2-yl]methyl]pyrazol-4-yl]-2-pyrazol-1-ylacetamide
CID 129355488
2-[(2R)-2-(1H-imidazol-2-yl)piperidin-1-yl]-N-(1-methylpyrazol-4-yl)-2-oxoacetamide
CID 124571602
2-cyclopentyl-N-[1-[[(2R)-oxan-2-yl]methyl]pyrazol-4-yl]acetamide
CID 129355562
4-(3-hydroxypropyl)-N-[1-(oxolan-2-ylmethyl)pyrazol-4-yl]piperidine-1-carboxamide
CID 154752369
1-[1-(oxan-2-ylmethyl)pyrazol-4-yl]-3-propan-2-ylurea
CID 121145347
N-[1-[[(2R)-oxolan-2-yl]methyl]pyrazol-4-yl]prop-2-enamide
CID 129365474
3-(1-methylpyrazol-4-yl)-N-[1-(oxolan-2-ylmethyl)pyrazol-4-yl]pyrrolidine-1-carboxamide
CID 136529661
2-(1H-imidazol-2-yl)-N-phenylpyrrolidine-1-carboxamide
CID 75401483

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(1H-imidazol-2-yl)-N-[1-[[(2S)-oxolan-2-yl]methyl]pyrazol-4-yl]piperidine-1-carboxamide?
The IUPAC name of (2S)-2-(1H-imidazol-2-yl)-N-[1-[[(2S)-oxolan-2-yl]methyl]pyrazol-4-yl]piperidine-1-carboxamide (CID 97054254) is (2S)-2-(1H-imidazol-2-yl)-N-[1-[[(2S)-oxolan-2-yl]methyl]pyrazol-4-yl]piperidine-1-carboxamide.
What is the SMILES notation for (2S)-2-(1H-imidazol-2-yl)-N-[1-[[(2S)-oxolan-2-yl]methyl]pyrazol-4-yl]piperidine-1-carboxamide?
The canonical SMILES for (2S)-2-(1H-imidazol-2-yl)-N-[1-[[(2S)-oxolan-2-yl]methyl]pyrazol-4-yl]piperidine-1-carboxamide is O=C(Nc1cnn(C[C@@H]2CCCO2)c1)N1CCCC[C@H]1c1ncc[nH]1.
What is the InChIKey of (2S)-2-(1H-imidazol-2-yl)-N-[1-[[(2S)-oxolan-2-yl]methyl]pyrazol-4-yl]piperidine-1-carboxamide?
The InChIKey is QGNPYAYCHNPFOW-GJZGRUSLSA-N. The full InChI is InChI=1S/C17H24N6O2/c24-17(23-8-2-1-5-15(23)16-18-6-7-19-16)21-13-10-20-22(11-13)12-14-4-3-9-25-14/h6-7,10-11,14-15H,1-5,8-9,12H2,(H,18,19)(H,21,24)/t14-,15-/m0/s1.
What are the key properties of (2S)-2-(1H-imidazol-2-yl)-N-[1-[[(2S)-oxolan-2-yl]methyl]pyrazol-4-yl]piperidine-1-carboxamide?
(2S)-2-(1H-imidazol-2-yl)-N-[1-[[(2S)-oxolan-2-yl]methyl]pyrazol-4-yl]piperidine-1-carboxamide has a molecular weight of 344.42 g/mol, XLogP of 2.54, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(1H-imidazol-2-yl)-N-[1-[[(2S)-oxolan-2-yl]methyl]pyrazol-4-yl]piperidine-1-carboxamide is sourced from PubChem (CID 97054254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).