(2R)-N-cyclopentyl-2-methyl-1-[2-(2-methylimidazol-1-yl)acetyl]pyrrolidine-2-carboxamide

C17H26N4O2 — CID 95851894

IUPAC(2R)-N-cyclopentyl-2-methyl-1-[2-(2-methylimidazol-1-yl)acetyl]pyrrolidine-2-carboxamide
SMILESCc1nccn1CC(=O)N1CCC[C@]1(C)C(=O)NC1CCCC1
InChIInChI=1S/C17H26N4O2/c1-13-18-9-11-20(13)12-15(22)21-10-5-8-17(21,2)16(23)19-14-6-3-4-7-14/h9,11,14H,3-8,10,12H2,1-2H3,(H,19,23)/t17-/m1/s1
InChIKeyKJOYTMOLJCDMFL-QGZVFWFLSA-N
MW318.42 g/mol
LogP1.63
Rot. Bonds4

About (2R)-N-cyclopentyl-2-methyl-1-[2-(2-methylimidazol-1-yl)acetyl]pyrrolidine-2-carboxamide

(2R)-N-cyclopentyl-2-methyl-1-[2-(2-methylimidazol-1-yl)acetyl]pyrrolidine-2-carboxamide (PubChem CID 95851894) has the molecular formula C17H26N4O2 and a molecular weight of 318.42 g/mol. Its IUPAC name is (2R)-N-cyclopentyl-2-methyl-1-[2-(2-methylimidazol-1-yl)acetyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-cyclopentyl-2-methyl-1-[2-(2-methylimidazol-1-yl)acetyl]pyrrolidine-2-carboxamide
PubChem CID95851894
Molecular FormulaC17H26N4O2
Molecular Weight318.42 g/mol
Exact Mass318.21
IUPAC Name(2R)-N-cyclopentyl-2-methyl-1-[2-(2-methylimidazol-1-yl)acetyl]pyrrolidine-2-carboxamide
SMILESCc1nccn1CC(=O)N1CCC[C@]1(C)C(=O)NC1CCCC1
InChIInChI=1S/C17H26N4O2/c1-13-18-9-11-20(13)12-15(22)21-10-5-8-17(21,2)16(23)19-14-6-3-4-7-14/h9,11,14H,3-8,10,12H2,1-2H3,(H,19,23)/t17-/m1/s1
InChIKeyKJOYTMOLJCDMFL-QGZVFWFLSA-N
XLogP1.63
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-N-cyclopentyl-2-methyl-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]pyrrolidine-2-carboxamide
CID 92632344
N-cyclopentyl-1-(1,3-dimethylpyrazole-4-carbonyl)-2-methylpyrrolidine-2-carboxamide
CID 110249134
N-cyclopropyl-2-(2-methylimidazol-1-yl)acetamide
CID 60731702
(2S)-3,3-dimethyl-1-[2-(2-methylimidazol-1-yl)acetyl]piperidine-2-carbonitrile
CID 129488339
1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanone
CID 115919041
(2S)-N-cyclopentyl-1-(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)-2-methylpyrrolidine-2-carboxamide
CID 92632323
3-methyl-1-[2-(2-methylimidazol-1-yl)acetyl]piperidine-3-carbonitrile
CID 131922462
(2S)-1-(2,1,3-benzothiadiazole-5-carbonyl)-N-cyclopentyl-2-methylpyrrolidine-2-carboxamide
CID 92632529
N-cyclohexyl-4-[(2-methylimidazol-1-yl)methyl]piperidine-1-carboxamide
CID 90494748
3-[3-hydroxy-1-[2-(2-methylimidazol-1-yl)acetyl]piperidin-3-yl]-N-methylpropanamide
CID 132948187
2-(2-methylimidazol-1-yl)-1-[(2R)-2-(1H-pyrazol-5-yl)piperidin-1-yl]ethanone
CID 124966203
2-cyclohexyl-1-[4-[2-(2-methylimidazol-1-yl)ethyl]piperazin-1-yl]ethanone
CID 90533668

Frequently Asked Questions

What is the IUPAC name of (2R)-N-cyclopentyl-2-methyl-1-[2-(2-methylimidazol-1-yl)acetyl]pyrrolidine-2-carboxamide?
The IUPAC name of (2R)-N-cyclopentyl-2-methyl-1-[2-(2-methylimidazol-1-yl)acetyl]pyrrolidine-2-carboxamide (CID 95851894) is (2R)-N-cyclopentyl-2-methyl-1-[2-(2-methylimidazol-1-yl)acetyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for (2R)-N-cyclopentyl-2-methyl-1-[2-(2-methylimidazol-1-yl)acetyl]pyrrolidine-2-carboxamide?
The canonical SMILES for (2R)-N-cyclopentyl-2-methyl-1-[2-(2-methylimidazol-1-yl)acetyl]pyrrolidine-2-carboxamide is Cc1nccn1CC(=O)N1CCC[C@]1(C)C(=O)NC1CCCC1.
What is the InChIKey of (2R)-N-cyclopentyl-2-methyl-1-[2-(2-methylimidazol-1-yl)acetyl]pyrrolidine-2-carboxamide?
The InChIKey is KJOYTMOLJCDMFL-QGZVFWFLSA-N. The full InChI is InChI=1S/C17H26N4O2/c1-13-18-9-11-20(13)12-15(22)21-10-5-8-17(21,2)16(23)19-14-6-3-4-7-14/h9,11,14H,3-8,10,12H2,1-2H3,(H,19,23)/t17-/m1/s1.
What are the key properties of (2R)-N-cyclopentyl-2-methyl-1-[2-(2-methylimidazol-1-yl)acetyl]pyrrolidine-2-carboxamide?
(2R)-N-cyclopentyl-2-methyl-1-[2-(2-methylimidazol-1-yl)acetyl]pyrrolidine-2-carboxamide has a molecular weight of 318.42 g/mol, XLogP of 1.63, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-cyclopentyl-2-methyl-1-[2-(2-methylimidazol-1-yl)acetyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 95851894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).