7-chloro-1-(2-piperidin-1-ylethyl)-1,8-naphthyridin-2-one

C15H18ClN3O — CID 141163144

IUPAC7-chloro-1-(2-piperidin-1-ylethyl)-1,8-naphthyridin-2-one
SMILESO=c1ccc2ccc(Cl)nc2n1CCN1CCCCC1
InChIInChI=1S/C15H18ClN3O/c16-13-6-4-12-5-7-14(20)19(15(12)17-13)11-10-18-8-2-1-3-9-18/h4-7H,1-3,8-11H2
InChIKeyBIRDPYYOOCUCCZ-UHFFFAOYSA-N
MW291.78 g/mol
LogP2.54
Rot. Bonds3

About 7-chloro-1-(2-piperidin-1-ylethyl)-1,8-naphthyridin-2-one

7-chloro-1-(2-piperidin-1-ylethyl)-1,8-naphthyridin-2-one (PubChem CID 141163144) has the molecular formula C15H18ClN3O and a molecular weight of 291.78 g/mol. Its IUPAC name is 7-chloro-1-(2-piperidin-1-ylethyl)-1,8-naphthyridin-2-one.

Molecular Properties

Compound Name7-chloro-1-(2-piperidin-1-ylethyl)-1,8-naphthyridin-2-one
PubChem CID141163144
Molecular FormulaC15H18ClN3O
Molecular Weight291.78 g/mol
Exact Mass291.11
IUPAC Name7-chloro-1-(2-piperidin-1-ylethyl)-1,8-naphthyridin-2-one
SMILESO=c1ccc2ccc(Cl)nc2n1CCN1CCCCC1
InChIInChI=1S/C15H18ClN3O/c16-13-6-4-12-5-7-14(20)19(15(12)17-13)11-10-18-8-2-1-3-9-18/h4-7H,1-3,8-11H2
InChIKeyBIRDPYYOOCUCCZ-UHFFFAOYSA-N
XLogP2.54
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.78
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

tert-butyl-[1-[2-(7-chloro-2-oxo-1,8-naphthyridin-1-yl)ethyl]piperidin-4-yl]carbamic acid
CID 86652542
5-chloro-3-(2-pyrrolidin-1-ylethyl)imidazo[4,5-b]pyridine
CID 24903989
7-chloro-1-(2,2-diethoxyethyl)-1,8-naphthyridin-2-one
CID 130302480
8-fluoro-2-oxo-1-(2-piperidin-1-ylethyl)quinoline-6-carboxylic acid
CID 94947485
2-chloro-6-(2-piperidin-1-ylethylsulfinyl)pyridine
CID 110175665
2-chloro-6-(2-piperidin-1-ylethylsulfanyl)pyridine
CID 51057856
2-(2-piperidin-1-ylethyl)-6-thiophen-2-ylpyridazin-3-one
CID 7659593
1-[2-[4-(cyclohexylmethyl)piperidin-1-yl]ethyl]quinolin-2-one
CID 67588198
3,6-dichloro-N-(2-pyrrolidin-1-ylethyl)pyridine-2-carboxamide
CID 1397872
N-[2-(azepan-1-yl)ethyl]-6-chloropyridin-2-amine
CID 107257793
6-naphthalen-1-yl-2-(2-piperidin-1-ylethyl)pyridazin-3-one
CID 7664936
7-bromo-1-(2-fluoroethyl)-1,8-naphthyridin-2-one
CID 156789811

Frequently Asked Questions

What is the IUPAC name of 7-chloro-1-(2-piperidin-1-ylethyl)-1,8-naphthyridin-2-one?
The IUPAC name of 7-chloro-1-(2-piperidin-1-ylethyl)-1,8-naphthyridin-2-one (CID 141163144) is 7-chloro-1-(2-piperidin-1-ylethyl)-1,8-naphthyridin-2-one.
What is the SMILES notation for 7-chloro-1-(2-piperidin-1-ylethyl)-1,8-naphthyridin-2-one?
The canonical SMILES for 7-chloro-1-(2-piperidin-1-ylethyl)-1,8-naphthyridin-2-one is O=c1ccc2ccc(Cl)nc2n1CCN1CCCCC1.
What is the InChIKey of 7-chloro-1-(2-piperidin-1-ylethyl)-1,8-naphthyridin-2-one?
The InChIKey is BIRDPYYOOCUCCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18ClN3O/c16-13-6-4-12-5-7-14(20)19(15(12)17-13)11-10-18-8-2-1-3-9-18/h4-7H,1-3,8-11H2.
What are the key properties of 7-chloro-1-(2-piperidin-1-ylethyl)-1,8-naphthyridin-2-one?
7-chloro-1-(2-piperidin-1-ylethyl)-1,8-naphthyridin-2-one has a molecular weight of 291.78 g/mol, XLogP of 2.54, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-1-(2-piperidin-1-ylethyl)-1,8-naphthyridin-2-one is sourced from PubChem (CID 141163144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).