4-chloro-N-methyl-N-[2-(naphthalen-1-ylamino)-2-oxoethyl]pyridine-2-carboxamide

C19H16ClN3O2 — CID 9463211

IUPAC4-chloro-N-methyl-N-[2-(naphthalen-1-ylamino)-2-oxoethyl]pyridine-2-carboxamide
SMILESCN(CC(=O)Nc1cccc2ccccc12)C(=O)c1cc(Cl)ccn1
InChIInChI=1S/C19H16ClN3O2/c1-23(19(25)17-11-14(20)9-10-21-17)12-18(24)22-16-8-4-6-13-5-2-3-7-15(13)16/h2-11H,12H2,1H3,(H,22,24)
InChIKeyHUCOBLAKFRLGSQ-UHFFFAOYSA-N
MW353.81 g/mol
LogP3.60
Rot. Bonds4

About 4-chloro-N-methyl-N-[2-(naphthalen-1-ylamino)-2-oxoethyl]pyridine-2-carboxamide

4-chloro-N-methyl-N-[2-(naphthalen-1-ylamino)-2-oxoethyl]pyridine-2-carboxamide (PubChem CID 9463211) has the molecular formula C19H16ClN3O2 and a molecular weight of 353.81 g/mol. Its IUPAC name is 4-chloro-N-methyl-N-[2-(naphthalen-1-ylamino)-2-oxoethyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-chloro-N-methyl-N-[2-(naphthalen-1-ylamino)-2-oxoethyl]pyridine-2-carboxamide
PubChem CID9463211
Molecular FormulaC19H16ClN3O2
Molecular Weight353.81 g/mol
Exact Mass353.09
IUPAC Name4-chloro-N-methyl-N-[2-(naphthalen-1-ylamino)-2-oxoethyl]pyridine-2-carboxamide
SMILESCN(CC(=O)Nc1cccc2ccccc12)C(=O)c1cc(Cl)ccn1
InChIInChI=1S/C19H16ClN3O2/c1-23(19(25)17-11-14(20)9-10-21-17)12-18(24)22-16-8-4-6-13-5-2-3-7-15(13)16/h2-11H,12H2,1H3,(H,22,24)
InChIKeyHUCOBLAKFRLGSQ-UHFFFAOYSA-N
XLogP3.60
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.81
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-N-[2-[[2-(2-ethylanilino)-2-oxoethyl]-methylamino]-2-oxoethyl]pyridine-2-carboxamide
CID 9378628
N-methyl-N-[2-(naphthalen-1-ylamino)-2-oxoethyl]furan-2-carboxamide
CID 26897595
4-chloro-N-[2-(3-methoxypropylamino)-2-oxoethyl]-N-methylpyridine-2-carboxamide
CID 60707787
2-(3-chlorophenyl)-N-[2-(2-ethylanilino)-2-oxoethyl]-N-methyl-1,3-thiazole-4-carboxamide
CID 55388630
2-[[2-(2-chlorophenoxy)acetyl]-methylamino]-N-naphthalen-1-ylacetamide
CID 4822554
3-(dimethylsulfamoyl)-N-methyl-N-[2-(naphthalen-1-ylamino)-2-oxoethyl]benzamide
CID 2504240
4-chloro-N-methyl-N-[(6-methyl-2-pyridinyl)methyl]pyridine-2-carboxamide
CID 79004039
N,5,7-trimethyl-N-[2-(naphthalen-1-ylamino)-2-oxoethyl]-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
CID 17431167
2-[(4-chlorophenyl)sulfonyl-methylamino]-N-naphthalen-1-ylacetamide
CID 1329391
4-amino-N-naphthalen-1-ylpyridine-2-carboxamide
CID 62152141
4-chloro-N-[2-(dimethylamino)phenyl]pyridine-2-carboxamide
CID 47166032
2-(diethylamino)-N-naphthalen-1-ylacetamide
CID 6421395

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-methyl-N-[2-(naphthalen-1-ylamino)-2-oxoethyl]pyridine-2-carboxamide?
The IUPAC name of 4-chloro-N-methyl-N-[2-(naphthalen-1-ylamino)-2-oxoethyl]pyridine-2-carboxamide (CID 9463211) is 4-chloro-N-methyl-N-[2-(naphthalen-1-ylamino)-2-oxoethyl]pyridine-2-carboxamide.
What is the SMILES notation for 4-chloro-N-methyl-N-[2-(naphthalen-1-ylamino)-2-oxoethyl]pyridine-2-carboxamide?
The canonical SMILES for 4-chloro-N-methyl-N-[2-(naphthalen-1-ylamino)-2-oxoethyl]pyridine-2-carboxamide is CN(CC(=O)Nc1cccc2ccccc12)C(=O)c1cc(Cl)ccn1.
What is the InChIKey of 4-chloro-N-methyl-N-[2-(naphthalen-1-ylamino)-2-oxoethyl]pyridine-2-carboxamide?
The InChIKey is HUCOBLAKFRLGSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClN3O2/c1-23(19(25)17-11-14(20)9-10-21-17)12-18(24)22-16-8-4-6-13-5-2-3-7-15(13)16/h2-11H,12H2,1H3,(H,22,24).
What are the key properties of 4-chloro-N-methyl-N-[2-(naphthalen-1-ylamino)-2-oxoethyl]pyridine-2-carboxamide?
4-chloro-N-methyl-N-[2-(naphthalen-1-ylamino)-2-oxoethyl]pyridine-2-carboxamide has a molecular weight of 353.81 g/mol, XLogP of 3.60, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-methyl-N-[2-(naphthalen-1-ylamino)-2-oxoethyl]pyridine-2-carboxamide is sourced from PubChem (CID 9463211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).