N-[6-(4-chloro-2-methylphenoxy)-3-pyridinyl]naphthalene-2-carboxamide

C23H17ClN2O2 — CID 18419514

IUPACN-[6-(4-chloro-2-methylphenoxy)-3-pyridinyl]naphthalene-2-carboxamide
SMILESCc1cc(Cl)ccc1Oc1ccc(NC(=O)c2ccc3ccccc3c2)cn1
InChIInChI=1S/C23H17ClN2O2/c1-15-12-19(24)8-10-21(15)28-22-11-9-20(14-25-22)26-23(27)18-7-6-16-4-2-3-5-17(16)13-18/h2-14H,1H3,(H,26,27)
InChIKeyMPOCLKYQAWYLBI-UHFFFAOYSA-N
MW388.85 g/mol
LogP6.24
Rot. Bonds4

About N-[6-(4-chloro-2-methylphenoxy)-3-pyridinyl]naphthalene-2-carboxamide

N-[6-(4-chloro-2-methylphenoxy)-3-pyridinyl]naphthalene-2-carboxamide (PubChem CID 18419514) has the molecular formula C23H17ClN2O2 and a molecular weight of 388.85 g/mol. Its IUPAC name is N-[6-(4-chloro-2-methylphenoxy)-3-pyridinyl]naphthalene-2-carboxamide.

Molecular Properties

Compound NameN-[6-(4-chloro-2-methylphenoxy)-3-pyridinyl]naphthalene-2-carboxamide
PubChem CID18419514
Molecular FormulaC23H17ClN2O2
Molecular Weight388.85 g/mol
Exact Mass388.10
IUPAC NameN-[6-(4-chloro-2-methylphenoxy)-3-pyridinyl]naphthalene-2-carboxamide
SMILESCc1cc(Cl)ccc1Oc1ccc(NC(=O)c2ccc3ccccc3c2)cn1
InChIInChI=1S/C23H17ClN2O2/c1-15-12-19(24)8-10-21(15)28-22-11-9-20(14-25-22)26-23(27)18-7-6-16-4-2-3-5-17(16)13-18/h2-14H,1H3,(H,26,27)
InChIKeyMPOCLKYQAWYLBI-UHFFFAOYSA-N
XLogP6.24
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500388.85
LogP ≤ 56.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[6-(2,4-dichlorophenoxy)-3-pyridinyl]-4-methylbenzamide
CID 40541033
N-[6-(2,4-dichlorophenoxy)-3-pyridinyl]-3-methylbenzamide;hydrochloride
CID 44641711
N-[6-(2,3-dimethylphenoxy)-3-pyridinyl]-4-phenoxybenzamide
CID 173468677
N-[6-(2,5-dimethylphenoxy)-3-pyridinyl]-4-methoxybenzamide
CID 42691206
tert-butyl N-methyl-N-[3-methyl-4-[[5-[(4-phenoxybenzoyl)amino]-2-pyridinyl]oxy]phenyl]carbamate
CID 140618549
N-[4-(naphthalene-2-carbonylamino)phenyl]naphthalene-2-carboxamide
CID 5120135
N-[3-[(3-chlorobenzoyl)amino]phenyl]naphthalene-2-carboxamide
CID 1366118
N-[4-(6-methylpyridazin-3-yl)oxyphenyl]naphthalene-2-carboxamide
CID 70703281
N-(3,4-difluorophenyl)naphthalene-2-carboxamide
CID 7771728
N-(2-phenoxypyrimidin-5-yl)naphthalene-2-carboxamide
CID 122302221
4-(3-chloro-2-pyridinyl)-3-methoxy-N-naphthalen-2-ylbenzamide
CID 59673439
6-(4-chloro-2-cyanophenoxy)-N-pyridin-3-ylpyridine-3-carboxamide
CID 66800670

Frequently Asked Questions

What is the IUPAC name of N-[6-(4-chloro-2-methylphenoxy)-3-pyridinyl]naphthalene-2-carboxamide?
The IUPAC name of N-[6-(4-chloro-2-methylphenoxy)-3-pyridinyl]naphthalene-2-carboxamide (CID 18419514) is N-[6-(4-chloro-2-methylphenoxy)-3-pyridinyl]naphthalene-2-carboxamide.
What is the SMILES notation for N-[6-(4-chloro-2-methylphenoxy)-3-pyridinyl]naphthalene-2-carboxamide?
The canonical SMILES for N-[6-(4-chloro-2-methylphenoxy)-3-pyridinyl]naphthalene-2-carboxamide is Cc1cc(Cl)ccc1Oc1ccc(NC(=O)c2ccc3ccccc3c2)cn1.
What is the InChIKey of N-[6-(4-chloro-2-methylphenoxy)-3-pyridinyl]naphthalene-2-carboxamide?
The InChIKey is MPOCLKYQAWYLBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17ClN2O2/c1-15-12-19(24)8-10-21(15)28-22-11-9-20(14-25-22)26-23(27)18-7-6-16-4-2-3-5-17(16)13-18/h2-14H,1H3,(H,26,27).
What are the key properties of N-[6-(4-chloro-2-methylphenoxy)-3-pyridinyl]naphthalene-2-carboxamide?
N-[6-(4-chloro-2-methylphenoxy)-3-pyridinyl]naphthalene-2-carboxamide has a molecular weight of 388.85 g/mol, XLogP of 6.24, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(4-chloro-2-methylphenoxy)-3-pyridinyl]naphthalene-2-carboxamide is sourced from PubChem (CID 18419514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).