N-(5-chloro-2-methylphenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide

C18H18ClN3O2 — CID 109094861

IUPACN-(5-chloro-2-methylphenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide
SMILESCc1ccc(Cl)cc1NC(=O)c1cccc(C(=O)N2CCCC2)n1
InChIInChI=1S/C18H18ClN3O2/c1-12-7-8-13(19)11-16(12)21-17(23)14-5-4-6-15(20-14)18(24)22-9-2-3-10-22/h4-8,11H,2-3,9-10H2,1H3,(H,21,23)
InChIKeySDYARFXTNQDCBY-UHFFFAOYSA-N
MW343.81 g/mol
LogP3.53
Rot. Bonds3

About N-(5-chloro-2-methylphenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide

N-(5-chloro-2-methylphenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide (PubChem CID 109094861) has the molecular formula C18H18ClN3O2 and a molecular weight of 343.81 g/mol. Its IUPAC name is N-(5-chloro-2-methylphenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(5-chloro-2-methylphenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide
PubChem CID109094861
Molecular FormulaC18H18ClN3O2
Molecular Weight343.81 g/mol
Exact Mass343.11
IUPAC NameN-(5-chloro-2-methylphenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide
SMILESCc1ccc(Cl)cc1NC(=O)c1cccc(C(=O)N2CCCC2)n1
InChIInChI=1S/C18H18ClN3O2/c1-12-7-8-13(19)11-16(12)21-17(23)14-5-4-6-15(20-14)18(24)22-9-2-3-10-22/h4-8,11H,2-3,9-10H2,1H3,(H,21,23)
InChIKeySDYARFXTNQDCBY-UHFFFAOYSA-N
XLogP3.53
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.81
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(azepane-1-carbonyl)-N-(3-chloro-4-methylphenyl)pyridine-2-carboxamide
CID 109099901
N-(2,5-dichlorophenyl)-6-(4-methylpiperazine-1-carbonyl)pyridine-2-carboxamide
CID 109096766
N-(2-chlorophenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide
CID 109094857
N-(5-chloro-2-methylphenyl)-4-(piperidine-1-carbonyl)benzamide
CID 109044656
N-[2-[(4-chlorophenyl)carbamoyl]phenyl]-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide
CID 166213729
6-(azepane-1-carbonyl)-N-(2,6-dichlorophenyl)pyridine-2-carboxamide
CID 109099941
N-(2,6-dichlorophenyl)-6-(piperidine-1-carbonyl)pyridine-2-carboxamide
CID 109095252
N-(2-ethylphenyl)-6-(piperidine-1-carbonyl)pyridine-2-carboxamide
CID 109095186
6-N-(5-chloro-2-methylphenyl)-2-N-[2-(dimethylamino)ethyl]pyridine-2,6-dicarboxamide
CID 109096365
N-(4-acetamidophenyl)-6-(piperidine-1-carbonyl)pyridine-2-carboxamide
CID 109095228
6-(4-acetylpiperazine-1-carbonyl)-N-(4-chlorophenyl)pyridine-2-carboxamide
CID 109097056
N-(3-methyl-1,2,4-thiadiazol-5-yl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide
CID 166216677

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methylphenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide?
The IUPAC name of N-(5-chloro-2-methylphenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide (CID 109094861) is N-(5-chloro-2-methylphenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide.
What is the SMILES notation for N-(5-chloro-2-methylphenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide?
The canonical SMILES for N-(5-chloro-2-methylphenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide is Cc1ccc(Cl)cc1NC(=O)c1cccc(C(=O)N2CCCC2)n1.
What is the InChIKey of N-(5-chloro-2-methylphenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide?
The InChIKey is SDYARFXTNQDCBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18ClN3O2/c1-12-7-8-13(19)11-16(12)21-17(23)14-5-4-6-15(20-14)18(24)22-9-2-3-10-22/h4-8,11H,2-3,9-10H2,1H3,(H,21,23).
What are the key properties of N-(5-chloro-2-methylphenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide?
N-(5-chloro-2-methylphenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide has a molecular weight of 343.81 g/mol, XLogP of 3.53, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methylphenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide is sourced from PubChem (CID 109094861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).