N-(4-chloro-2-pyridinyl)-3,4-dihydro-2H-chromene-3-carboxamide

C15H13ClN2O2 — CID 115627234

IUPACN-(4-chloro-2-pyridinyl)-3,4-dihydro-2H-chromene-3-carboxamide
SMILESO=C(Nc1cc(Cl)ccn1)C1COc2ccccc2C1
InChIInChI=1S/C15H13ClN2O2/c16-12-5-6-17-14(8-12)18-15(19)11-7-10-3-1-2-4-13(10)20-9-11/h1-6,8,11H,7,9H2,(H,17,18,19)
InChIKeyYSGLHNFJIKMUOH-UHFFFAOYSA-N
MW288.73 g/mol
LogP2.92
Rot. Bonds2

About N-(4-chloro-2-pyridinyl)-3,4-dihydro-2H-chromene-3-carboxamide

N-(4-chloro-2-pyridinyl)-3,4-dihydro-2H-chromene-3-carboxamide (PubChem CID 115627234) has the molecular formula C15H13ClN2O2 and a molecular weight of 288.73 g/mol. Its IUPAC name is N-(4-chloro-2-pyridinyl)-3,4-dihydro-2H-chromene-3-carboxamide.

Molecular Properties

Compound NameN-(4-chloro-2-pyridinyl)-3,4-dihydro-2H-chromene-3-carboxamide
PubChem CID115627234
Molecular FormulaC15H13ClN2O2
Molecular Weight288.73 g/mol
Exact Mass288.07
IUPAC NameN-(4-chloro-2-pyridinyl)-3,4-dihydro-2H-chromene-3-carboxamide
SMILESO=C(Nc1cc(Cl)ccn1)C1COc2ccccc2C1
InChIInChI=1S/C15H13ClN2O2/c16-12-5-6-17-14(8-12)18-15(19)11-7-10-3-1-2-4-13(10)20-9-11/h1-6,8,11H,7,9H2,(H,17,18,19)
InChIKeyYSGLHNFJIKMUOH-UHFFFAOYSA-N
XLogP2.92
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.73
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(4-chloro-2-pyridinyl)-3,4-dihydro-2H-chromene-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-chloropyrimidin-4-yl)-3,4-dihydro-2H-chromene-3-carboxamide
CID 116798426
N-(4-chloro-2-pyridinyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide
CID 108797604
N-(2-bromo-4-chlorophenyl)-3,4-dihydro-2H-chromene-3-carboxamide
CID 81028513
N-(4-chloro-2-methylphenyl)-3,4-dihydro-2H-chromene-3-carboxamide
CID 22578098
N-(2-amino-5-chlorophenyl)-3,4-dihydro-2H-chromene-3-carboxamide
CID 63563206
N-(4,6-dimethyl-2-pyridinyl)-3,4-dihydro-2H-chromene-3-carboxamide
CID 22105811
N-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]-3,4-dihydro-2H-chromene-3-carboxamide
CID 55480745
N-(3-amino-4-chlorophenyl)-3,4-dihydro-2H-chromene-3-carboxamide
CID 62057632
N-(3,5-dibromopyrazin-2-yl)-3,4-dihydro-2H-chromene-3-carboxamide
CID 103756350
(3R)-6-chloro-N-(1,3-thiazol-2-yl)-3,4-dihydro-2H-chromene-3-carboxamide
CID 41095377
(3S)-N-[(2,4-dichlorophenyl)methyl]-3,4-dihydro-2H-chromene-3-carboxamide
CID 9244994
(3R)-N-methyl-N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]-3,4-dihydro-2H-chromene-3-carboxamide
CID 95335512

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-pyridinyl)-3,4-dihydro-2H-chromene-3-carboxamide?
The IUPAC name of N-(4-chloro-2-pyridinyl)-3,4-dihydro-2H-chromene-3-carboxamide (CID 115627234) is N-(4-chloro-2-pyridinyl)-3,4-dihydro-2H-chromene-3-carboxamide.
What is the SMILES notation for N-(4-chloro-2-pyridinyl)-3,4-dihydro-2H-chromene-3-carboxamide?
The canonical SMILES for N-(4-chloro-2-pyridinyl)-3,4-dihydro-2H-chromene-3-carboxamide is O=C(Nc1cc(Cl)ccn1)C1COc2ccccc2C1.
What is the InChIKey of N-(4-chloro-2-pyridinyl)-3,4-dihydro-2H-chromene-3-carboxamide?
The InChIKey is YSGLHNFJIKMUOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClN2O2/c16-12-5-6-17-14(8-12)18-15(19)11-7-10-3-1-2-4-13(10)20-9-11/h1-6,8,11H,7,9H2,(H,17,18,19).
What are the key properties of N-(4-chloro-2-pyridinyl)-3,4-dihydro-2H-chromene-3-carboxamide?
N-(4-chloro-2-pyridinyl)-3,4-dihydro-2H-chromene-3-carboxamide has a molecular weight of 288.73 g/mol, XLogP of 2.92, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-pyridinyl)-3,4-dihydro-2H-chromene-3-carboxamide is sourced from PubChem (CID 115627234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).