(2R)-N-[2-[4-(4-chlorophenyl)-5-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]oxolane-2-carboxamide

C20H22ClN5O2 — CID 92567594

IUPAC(2R)-N-[2-[4-(4-chlorophenyl)-5-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]oxolane-2-carboxamide
SMILESCn1ccnc1-c1c(-c2ccc(Cl)cc2)cnn1CCNC(=O)[C@H]1CCCO1
InChIInChI=1S/C20H22ClN5O2/c1-25-10-8-22-19(25)18-16(14-4-6-15(21)7-5-14)13-24-26(18)11-9-23-20(27)17-3-2-12-28-17/h4-8,10,13,17H,2-3,9,11-12H2,1H3,(H,23,27)/t17-/m1/s1
InChIKeyHVCMZXFFEGNKTM-QGZVFWFLSA-N
MW399.88 g/mol
LogP2.90
Rot. Bonds6

About (2R)-N-[2-[4-(4-chlorophenyl)-5-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]oxolane-2-carboxamide

(2R)-N-[2-[4-(4-chlorophenyl)-5-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]oxolane-2-carboxamide (PubChem CID 92567594) has the molecular formula C20H22ClN5O2 and a molecular weight of 399.88 g/mol. Its IUPAC name is (2R)-N-[2-[4-(4-chlorophenyl)-5-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]oxolane-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-[2-[4-(4-chlorophenyl)-5-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]oxolane-2-carboxamide
PubChem CID92567594
Molecular FormulaC20H22ClN5O2
Molecular Weight399.88 g/mol
Exact Mass399.15
IUPAC Name(2R)-N-[2-[4-(4-chlorophenyl)-5-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]oxolane-2-carboxamide
SMILESCn1ccnc1-c1c(-c2ccc(Cl)cc2)cnn1CCNC(=O)[C@H]1CCCO1
InChIInChI=1S/C20H22ClN5O2/c1-25-10-8-22-19(25)18-16(14-4-6-15(21)7-5-14)13-24-26(18)11-9-23-20(27)17-3-2-12-28-17/h4-8,10,13,17H,2-3,9,11-12H2,1H3,(H,23,27)/t17-/m1/s1
InChIKeyHVCMZXFFEGNKTM-QGZVFWFLSA-N
XLogP2.90
TPSA73.97 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.88
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze (2R)-N-[2-[4-(4-chlorophenyl)-5-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]oxolane-2-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-[5-(6-methyl-3-pyridinyl)-4-pyridin-4-ylpyrazol-1-yl]ethyl]oxolane-2-carboxamide
CID 110242829
N-[2-[4-(4-fluorophenyl)-5-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]-3,4-dihydro-1H-isochromene-1-carboxamide
CID 110239900
N-[2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]ethyl]oxolane-2-carboxamide
CID 110314737
N-[2-[4-(4-fluorophenyl)-5-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]-2-(2-methoxyphenyl)acetamide
CID 92567615
N-[2-(5-methyl-6-oxopyrimidin-1-yl)ethyl]oxolane-2-carboxamide
CID 121121018
(2R)-N-[2-(4-chlorophenyl)pyrimidin-5-yl]oxolane-2-carboxamide
CID 95100497
(2S)-N-[[(2S)-7-(4-chlorophenyl)-5-methyl-2,3-dihydro-1-benzofuran-2-yl]methyl]oxolane-2-carboxamide
CID 26322064
N-[4-(4-chloroanilino)-4-oxobutyl]oxolane-2-carboxamide
CID 47067239
N-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]oxolane-2-carboxamide
CID 71993905
(2R)-N-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]oxolane-2-carboxamide
CID 35593011
ethyl 4-(4-chlorophenyl)-2-[[(2R)-oxolane-2-carbonyl]amino]thiophene-3-carboxylate
CID 1147024
N-[2-(N-acetyl-4-chloro-2-methylanilino)ethyl]oxolane-2-carboxamide
CID 113059887

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[2-[4-(4-chlorophenyl)-5-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]oxolane-2-carboxamide?
The IUPAC name of (2R)-N-[2-[4-(4-chlorophenyl)-5-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]oxolane-2-carboxamide (CID 92567594) is (2R)-N-[2-[4-(4-chlorophenyl)-5-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]oxolane-2-carboxamide.
What is the SMILES notation for (2R)-N-[2-[4-(4-chlorophenyl)-5-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]oxolane-2-carboxamide?
The canonical SMILES for (2R)-N-[2-[4-(4-chlorophenyl)-5-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]oxolane-2-carboxamide is Cn1ccnc1-c1c(-c2ccc(Cl)cc2)cnn1CCNC(=O)[C@H]1CCCO1.
What is the InChIKey of (2R)-N-[2-[4-(4-chlorophenyl)-5-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]oxolane-2-carboxamide?
The InChIKey is HVCMZXFFEGNKTM-QGZVFWFLSA-N. The full InChI is InChI=1S/C20H22ClN5O2/c1-25-10-8-22-19(25)18-16(14-4-6-15(21)7-5-14)13-24-26(18)11-9-23-20(27)17-3-2-12-28-17/h4-8,10,13,17H,2-3,9,11-12H2,1H3,(H,23,27)/t17-/m1/s1.
What are the key properties of (2R)-N-[2-[4-(4-chlorophenyl)-5-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]oxolane-2-carboxamide?
(2R)-N-[2-[4-(4-chlorophenyl)-5-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]oxolane-2-carboxamide has a molecular weight of 399.88 g/mol, XLogP of 2.90, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[2-[4-(4-chlorophenyl)-5-(1-methylimidazol-2-yl)pyrazol-1-yl]ethyl]oxolane-2-carboxamide is sourced from PubChem (CID 92567594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).