N-cyclohexyl-5-(pyrrolidine-1-carbonyl)pyridine-3-carboxamide

C17H23N3O2 — CID 109102478

IUPACN-cyclohexyl-5-(pyrrolidine-1-carbonyl)pyridine-3-carboxamide
SMILESO=C(NC1CCCCC1)c1cncc(C(=O)N2CCCC2)c1
InChIInChI=1S/C17H23N3O2/c21-16(19-15-6-2-1-3-7-15)13-10-14(12-18-11-13)17(22)20-8-4-5-9-20/h10-12,15H,1-9H2,(H,19,21)
InChIKeyGIIUPOIHCBQEFR-UHFFFAOYSA-N
MW301.39 g/mol
LogP2.38
Rot. Bonds3

About N-cyclohexyl-5-(pyrrolidine-1-carbonyl)pyridine-3-carboxamide

N-cyclohexyl-5-(pyrrolidine-1-carbonyl)pyridine-3-carboxamide (PubChem CID 109102478) has the molecular formula C17H23N3O2 and a molecular weight of 301.39 g/mol. Its IUPAC name is N-cyclohexyl-5-(pyrrolidine-1-carbonyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-5-(pyrrolidine-1-carbonyl)pyridine-3-carboxamide
PubChem CID109102478
Molecular FormulaC17H23N3O2
Molecular Weight301.39 g/mol
Exact Mass301.18
IUPAC NameN-cyclohexyl-5-(pyrrolidine-1-carbonyl)pyridine-3-carboxamide
SMILESO=C(NC1CCCCC1)c1cncc(C(=O)N2CCCC2)c1
InChIInChI=1S/C17H23N3O2/c21-16(19-15-6-2-1-3-7-15)13-10-14(12-18-11-13)17(22)20-8-4-5-9-20/h10-12,15H,1-9H2,(H,19,21)
InChIKeyGIIUPOIHCBQEFR-UHFFFAOYSA-N
XLogP2.38
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cycloheptyl-5-(pyrrolidine-1-carbonyl)pyridine-3-carboxamide
CID 109102544
5-(azepane-1-carbonyl)-N-cyclopentylpyridine-3-carboxamide
CID 109102737
N-cycloheptyl-5-(4-methylpiperazine-1-carbonyl)pyridine-3-carboxamide
CID 109104440
N-cyclohexyl-5-(4-methylpiperidine-1-carbonyl)pyridine-3-carboxamide
CID 109102999
3-N-cyclopentyl-5-N-cyclopropylpyridine-3,5-dicarboxamide
CID 109101527
N-(1,1-dioxothiolan-3-yl)-5-(pyrrolidine-1-carbonyl)pyridine-3-carboxamide
CID 109102518
N-cycloheptyl-3-(pyrrolidine-1-carbonyl)benzamide
CID 109051684
N-cyclopentyl-5-piperidin-1-ylpyridine-3-carboxamide
CID 109225879
N-cyclohexyl-4-(5-hydroxypyridine-3-carbonyl)piperazine-1-carboxamide
CID 138994284
N-cyclohexyl-4-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide
CID 109080315
5-N-tert-butyl-3-N-cycloheptylpyridine-3,5-dicarboxamide
CID 109106897
5-N-cyclohexyl-3-N-propylpyridine-3,5-dicarboxamide
CID 109101138

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-5-(pyrrolidine-1-carbonyl)pyridine-3-carboxamide?
The IUPAC name of N-cyclohexyl-5-(pyrrolidine-1-carbonyl)pyridine-3-carboxamide (CID 109102478) is N-cyclohexyl-5-(pyrrolidine-1-carbonyl)pyridine-3-carboxamide.
What is the SMILES notation for N-cyclohexyl-5-(pyrrolidine-1-carbonyl)pyridine-3-carboxamide?
The canonical SMILES for N-cyclohexyl-5-(pyrrolidine-1-carbonyl)pyridine-3-carboxamide is O=C(NC1CCCCC1)c1cncc(C(=O)N2CCCC2)c1.
What is the InChIKey of N-cyclohexyl-5-(pyrrolidine-1-carbonyl)pyridine-3-carboxamide?
The InChIKey is GIIUPOIHCBQEFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O2/c21-16(19-15-6-2-1-3-7-15)13-10-14(12-18-11-13)17(22)20-8-4-5-9-20/h10-12,15H,1-9H2,(H,19,21).
What are the key properties of N-cyclohexyl-5-(pyrrolidine-1-carbonyl)pyridine-3-carboxamide?
N-cyclohexyl-5-(pyrrolidine-1-carbonyl)pyridine-3-carboxamide has a molecular weight of 301.39 g/mol, XLogP of 2.38, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-5-(pyrrolidine-1-carbonyl)pyridine-3-carboxamide is sourced from PubChem (CID 109102478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).