1-(cyclohexanecarbonyl)-N-(6-pyrazol-1-yl-3-pyridinyl)pyrrolidine-2-carboxamide

C20H25N5O2 — CID 55762135

IUPAC1-(cyclohexanecarbonyl)-N-(6-pyrazol-1-yl-3-pyridinyl)pyrrolidine-2-carboxamide
SMILESO=C(Nc1ccc(-n2cccn2)nc1)C1CCCN1C(=O)C1CCCCC1
InChIInChI=1S/C20H25N5O2/c26-19(23-16-9-10-18(21-14-16)25-13-5-11-22-25)17-8-4-12-24(17)20(27)15-6-2-1-3-7-15/h5,9-11,13-15,17H,1-4,6-8,12H2,(H,23,26)
InChIKeyPOTVMTHGOZLTII-UHFFFAOYSA-N
MW367.45 g/mol
LogP2.78
Rot. Bonds4

About 1-(cyclohexanecarbonyl)-N-(6-pyrazol-1-yl-3-pyridinyl)pyrrolidine-2-carboxamide

1-(cyclohexanecarbonyl)-N-(6-pyrazol-1-yl-3-pyridinyl)pyrrolidine-2-carboxamide (PubChem CID 55762135) has the molecular formula C20H25N5O2 and a molecular weight of 367.45 g/mol. Its IUPAC name is 1-(cyclohexanecarbonyl)-N-(6-pyrazol-1-yl-3-pyridinyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-(cyclohexanecarbonyl)-N-(6-pyrazol-1-yl-3-pyridinyl)pyrrolidine-2-carboxamide
PubChem CID55762135
Molecular FormulaC20H25N5O2
Molecular Weight367.45 g/mol
Exact Mass367.20
IUPAC Name1-(cyclohexanecarbonyl)-N-(6-pyrazol-1-yl-3-pyridinyl)pyrrolidine-2-carboxamide
SMILESO=C(Nc1ccc(-n2cccn2)nc1)C1CCCN1C(=O)C1CCCCC1
InChIInChI=1S/C20H25N5O2/c26-19(23-16-9-10-18(21-14-16)25-13-5-11-22-25)17-8-4-12-24(17)20(27)15-6-2-1-3-7-15/h5,9-11,13-15,17H,1-4,6-8,12H2,(H,23,26)
InChIKeyPOTVMTHGOZLTII-UHFFFAOYSA-N
XLogP2.78
TPSA80.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.45
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[6-(benzimidazol-1-yl)-3-pyridinyl]-1-(cyclohexanecarbonyl)pyrrolidine-2-carboxamide
CID 55761391
1-(cyclopropanecarbonyl)-N-(3-fluoro-4-pyrazol-1-ylphenyl)pyrrolidine-2-carboxamide
CID 126769711
(2S)-1-(cyclohexanecarbonyl)-N-(6-methoxy-3-pyridinyl)pyrrolidine-2-carboxamide
CID 51951158
4-amino-N-(6-pyrazol-1-yl-3-pyridinyl)cyclohexane-1-carboxamide
CID 60849056
1-benzyl-N-(6-pyrazol-1-yl-3-pyridinyl)piperidine-3-carboxamide
CID 47804635
N-(4-anilinophenyl)-1-(cyclopentanecarbonyl)pyrrolidine-2-carboxamide
CID 166197699
N-(6-pyrazol-1-yl-3-pyridinyl)pyrrolidine-2-carboxamide
CID 43426246
sodium 3-[(6-pyrazol-1-yl-3-pyridinyl)carbamoyl]cyclobutane-1-carboxylate
CID 166228956
N-(6-pyrazol-1-yl-3-pyridinyl)acetamide
CID 47153389
N-(3-bromophenyl)-1-(cyclohexanecarbonyl)pyrrolidine-2-carboxamide
CID 55741021
(2S)-N-(4-chlorophenyl)-1-(cyclopropanecarbonyl)pyrrolidine-2-carboxamide
CID 110286201
1-(6-cyanopyridine-3-carbonyl)-N-(4-pyrazol-1-ylphenyl)piperidine-2-carboxamide
CID 72898522

Frequently Asked Questions

What is the IUPAC name of 1-(cyclohexanecarbonyl)-N-(6-pyrazol-1-yl-3-pyridinyl)pyrrolidine-2-carboxamide?
The IUPAC name of 1-(cyclohexanecarbonyl)-N-(6-pyrazol-1-yl-3-pyridinyl)pyrrolidine-2-carboxamide (CID 55762135) is 1-(cyclohexanecarbonyl)-N-(6-pyrazol-1-yl-3-pyridinyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for 1-(cyclohexanecarbonyl)-N-(6-pyrazol-1-yl-3-pyridinyl)pyrrolidine-2-carboxamide?
The canonical SMILES for 1-(cyclohexanecarbonyl)-N-(6-pyrazol-1-yl-3-pyridinyl)pyrrolidine-2-carboxamide is O=C(Nc1ccc(-n2cccn2)nc1)C1CCCN1C(=O)C1CCCCC1.
What is the InChIKey of 1-(cyclohexanecarbonyl)-N-(6-pyrazol-1-yl-3-pyridinyl)pyrrolidine-2-carboxamide?
The InChIKey is POTVMTHGOZLTII-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N5O2/c26-19(23-16-9-10-18(21-14-16)25-13-5-11-22-25)17-8-4-12-24(17)20(27)15-6-2-1-3-7-15/h5,9-11,13-15,17H,1-4,6-8,12H2,(H,23,26).
What are the key properties of 1-(cyclohexanecarbonyl)-N-(6-pyrazol-1-yl-3-pyridinyl)pyrrolidine-2-carboxamide?
1-(cyclohexanecarbonyl)-N-(6-pyrazol-1-yl-3-pyridinyl)pyrrolidine-2-carboxamide has a molecular weight of 367.45 g/mol, XLogP of 2.78, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclohexanecarbonyl)-N-(6-pyrazol-1-yl-3-pyridinyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 55762135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).