N-[3-(2-chlorophenyl)-3-hydroxypropyl]-1,6-naphthyridine-8-carboxamide

C18H16ClN3O2 — CID 91949020

IUPACN-[3-(2-chlorophenyl)-3-hydroxypropyl]-1,6-naphthyridine-8-carboxamide
SMILESO=C(NCCC(O)c1ccccc1Cl)c1cncc2cccnc12
InChIInChI=1S/C18H16ClN3O2/c19-15-6-2-1-5-13(15)16(23)7-9-22-18(24)14-11-20-10-12-4-3-8-21-17(12)14/h1-6,8,10-11,16,23H,7,9H2,(H,22,24)
InChIKeyFULCNLSVEGDMRG-UHFFFAOYSA-N
MW341.80 g/mol
LogP3.14
Rot. Bonds5

About N-[3-(2-chlorophenyl)-3-hydroxypropyl]-1,6-naphthyridine-8-carboxamide

N-[3-(2-chlorophenyl)-3-hydroxypropyl]-1,6-naphthyridine-8-carboxamide (PubChem CID 91949020) has the molecular formula C18H16ClN3O2 and a molecular weight of 341.80 g/mol. Its IUPAC name is N-[3-(2-chlorophenyl)-3-hydroxypropyl]-1,6-naphthyridine-8-carboxamide.

Molecular Properties

Compound NameN-[3-(2-chlorophenyl)-3-hydroxypropyl]-1,6-naphthyridine-8-carboxamide
PubChem CID91949020
Molecular FormulaC18H16ClN3O2
Molecular Weight341.80 g/mol
Exact Mass341.09
IUPAC NameN-[3-(2-chlorophenyl)-3-hydroxypropyl]-1,6-naphthyridine-8-carboxamide
SMILESO=C(NCCC(O)c1ccccc1Cl)c1cncc2cccnc12
InChIInChI=1S/C18H16ClN3O2/c19-15-6-2-1-5-13(15)16(23)7-9-22-18(24)14-11-20-10-12-4-3-8-21-17(12)14/h1-6,8,10-11,16,23H,7,9H2,(H,22,24)
InChIKeyFULCNLSVEGDMRG-UHFFFAOYSA-N
XLogP3.14
TPSA75.11 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.80
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methylpropyl)-1,6-naphthyridine-8-carboxamide
CID 91949075
N-(2-morpholin-4-ylethyl)-1,6-naphthyridine-8-carboxamide
CID 91949050
N-(3-morpholin-4-ylpropyl)-1,6-naphthyridine-8-carboxamide
CID 91949073
N-[2-(2-chlorophenyl)-2-hydroxyethyl]-2-methoxypyridine-3-carboxamide
CID 111451178
N-[2-(5-fluoro-2-methyl-1H-indol-3-yl)ethyl]-1,6-naphthyridine-8-carboxamide
CID 91949032
3-chloro-5-methyl-2-[(1,6-naphthyridine-8-carbonylamino)methyl]-1-benzofuran-7-carboxylic acid
CID 164866328
N-(3,3-diphenylpropyl)-8-hydroxyquinoline-7-carboxamide
CID 18372579
N-[1-(2-chlorophenyl)ethyl]-N-methylquinoline-8-carboxamide
CID 86882760
N-[3-(6-methylindazol-1-yl)propyl]-1,6-naphthyridine-8-carboxamide
CID 91949000
2-chloro-N-[(3R)-3-hydroxybutyl]pyridine-3-carboxamide
CID 86323911
N-(3-hydroxy-3-naphthalen-1-ylpropyl)-1-methyl-2-oxopyridine-3-carboxamide
CID 71787922
N-(3,3-diphenylpropyl)-8-hydroxy-1,6-naphthyridine-7-carboxamide
CID 10293333

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-chlorophenyl)-3-hydroxypropyl]-1,6-naphthyridine-8-carboxamide?
The IUPAC name of N-[3-(2-chlorophenyl)-3-hydroxypropyl]-1,6-naphthyridine-8-carboxamide (CID 91949020) is N-[3-(2-chlorophenyl)-3-hydroxypropyl]-1,6-naphthyridine-8-carboxamide.
What is the SMILES notation for N-[3-(2-chlorophenyl)-3-hydroxypropyl]-1,6-naphthyridine-8-carboxamide?
The canonical SMILES for N-[3-(2-chlorophenyl)-3-hydroxypropyl]-1,6-naphthyridine-8-carboxamide is O=C(NCCC(O)c1ccccc1Cl)c1cncc2cccnc12.
What is the InChIKey of N-[3-(2-chlorophenyl)-3-hydroxypropyl]-1,6-naphthyridine-8-carboxamide?
The InChIKey is FULCNLSVEGDMRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16ClN3O2/c19-15-6-2-1-5-13(15)16(23)7-9-22-18(24)14-11-20-10-12-4-3-8-21-17(12)14/h1-6,8,10-11,16,23H,7,9H2,(H,22,24).
What are the key properties of N-[3-(2-chlorophenyl)-3-hydroxypropyl]-1,6-naphthyridine-8-carboxamide?
N-[3-(2-chlorophenyl)-3-hydroxypropyl]-1,6-naphthyridine-8-carboxamide has a molecular weight of 341.80 g/mol, XLogP of 3.14, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-chlorophenyl)-3-hydroxypropyl]-1,6-naphthyridine-8-carboxamide is sourced from PubChem (CID 91949020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).