N-(8-chloro-3,4-dihydro-2H-chromen-4-yl)-2-hydroxybenzamide

C16H14ClNO3 — CID 60572033

IUPACN-(8-chloro-3,4-dihydro-2H-chromen-4-yl)-2-hydroxybenzamide
SMILESO=C(NC1CCOc2c(Cl)cccc21)c1ccccc1O
InChIInChI=1S/C16H14ClNO3/c17-12-6-3-5-10-13(8-9-21-15(10)12)18-16(20)11-4-1-2-7-14(11)19/h1-7,13,19H,8-9H2,(H,18,20)
InChIKeyVJFQEUSTSRPUOW-UHFFFAOYSA-N
MW303.75 g/mol
LogP3.30
Rot. Bonds2

About N-(8-chloro-3,4-dihydro-2H-chromen-4-yl)-2-hydroxybenzamide

N-(8-chloro-3,4-dihydro-2H-chromen-4-yl)-2-hydroxybenzamide (PubChem CID 60572033) has the molecular formula C16H14ClNO3 and a molecular weight of 303.75 g/mol. Its IUPAC name is N-(8-chloro-3,4-dihydro-2H-chromen-4-yl)-2-hydroxybenzamide.

Molecular Properties

Compound NameN-(8-chloro-3,4-dihydro-2H-chromen-4-yl)-2-hydroxybenzamide
PubChem CID60572033
Molecular FormulaC16H14ClNO3
Molecular Weight303.75 g/mol
Exact Mass303.07
IUPAC NameN-(8-chloro-3,4-dihydro-2H-chromen-4-yl)-2-hydroxybenzamide
SMILESO=C(NC1CCOc2c(Cl)cccc21)c1ccccc1O
InChIInChI=1S/C16H14ClNO3/c17-12-6-3-5-10-13(8-9-21-15(10)12)18-16(20)11-4-1-2-7-14(11)19/h1-7,13,19H,8-9H2,(H,18,20)
InChIKeyVJFQEUSTSRPUOW-UHFFFAOYSA-N
XLogP3.30
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.75
LogP ≤ 53.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(8-chloro-3,4-dihydro-2H-chromen-4-yl)-2-hydroxybenzamide 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-(8-chloro-3,4-dihydro-2H-chromen-4-yl)-2-methylquinoline-4-carboxamide
CID 60571804
4-acetamido-N-(8-chloro-3,4-dihydro-2H-chromen-4-yl)benzamide
CID 60572091
N-(8-chloro-3,4-dihydro-2H-chromen-4-yl)-3,5-dinitrobenzamide
CID 60572063
N-(8-chloro-3,4-dihydro-2H-chromen-4-yl)piperidine-4-carboxamide
CID 119301911
trans-(1R,2R)-2-[[(4R)-8-chloro-3,4-dihydro-2H-chromen-4-yl]carbamoyl]cyclopropane-1-carboxylic acid
CID 125119661
N-[(4S)-8-chloro-3,4-dihydro-2H-chromen-4-yl]-2-(methylamino)pyridine-4-carboxamide
CID 124882769
N-[(4S)-8-chloro-3,4-dihydro-2H-chromen-4-yl]-5-ethyl-1-(2-methylpropyl)pyrazole-4-carboxamide
CID 124614344
N-(8-chloro-3,4-dihydro-2H-chromen-4-yl)-5-ethyl-1-(2-methylpropyl)pyrazole-4-carboxamide
CID 119042913
N-(8-chloro-3,4-dihydro-2H-chromen-4-yl)-3-methylazetidine-3-carboxamide
CID 128874525
N-(8-chloro-3,4-dihydro-2H-chromen-4-yl)-2-methyl-3-(methylamino)propanamide
CID 119746250
1-benzyl-N-[(4S)-8-chloro-3,4-dihydro-2H-chromen-4-yl]piperidine-4-carboxamide
CID 95279883
3-amino-N-(8-chloro-3,4-dihydro-2H-chromen-4-yl)-3-phenylpropanamide;hydrochloride
CID 119950489

Frequently Asked Questions

What is the IUPAC name of N-(8-chloro-3,4-dihydro-2H-chromen-4-yl)-2-hydroxybenzamide?
The IUPAC name of N-(8-chloro-3,4-dihydro-2H-chromen-4-yl)-2-hydroxybenzamide (CID 60572033) is N-(8-chloro-3,4-dihydro-2H-chromen-4-yl)-2-hydroxybenzamide.
What is the SMILES notation for N-(8-chloro-3,4-dihydro-2H-chromen-4-yl)-2-hydroxybenzamide?
The canonical SMILES for N-(8-chloro-3,4-dihydro-2H-chromen-4-yl)-2-hydroxybenzamide is O=C(NC1CCOc2c(Cl)cccc21)c1ccccc1O.
What is the InChIKey of N-(8-chloro-3,4-dihydro-2H-chromen-4-yl)-2-hydroxybenzamide?
The InChIKey is VJFQEUSTSRPUOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14ClNO3/c17-12-6-3-5-10-13(8-9-21-15(10)12)18-16(20)11-4-1-2-7-14(11)19/h1-7,13,19H,8-9H2,(H,18,20).
What are the key properties of N-(8-chloro-3,4-dihydro-2H-chromen-4-yl)-2-hydroxybenzamide?
N-(8-chloro-3,4-dihydro-2H-chromen-4-yl)-2-hydroxybenzamide has a molecular weight of 303.75 g/mol, XLogP of 3.30, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8-chloro-3,4-dihydro-2H-chromen-4-yl)-2-hydroxybenzamide is sourced from PubChem (CID 60572033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).