7-chloro-2-(1-piperidin-4-ylethenyl)-1,6-naphthyridine

C15H16ClN3 — CID 156719458

IUPAC7-chloro-2-(1-piperidin-4-ylethenyl)-1,6-naphthyridine
SMILESC=C(c1ccc2cnc(Cl)cc2n1)C1CCNCC1
InChIInChI=1S/C15H16ClN3/c1-10(11-4-6-17-7-5-11)13-3-2-12-9-18-15(16)8-14(12)19-13/h2-3,8-9,11,17H,1,4-7H2
InChIKeyDNFHQULRJHZGOO-UHFFFAOYSA-N
MW273.77 g/mol
LogP3.30
Rot. Bonds2

About 7-chloro-2-(1-piperidin-4-ylethenyl)-1,6-naphthyridine

7-chloro-2-(1-piperidin-4-ylethenyl)-1,6-naphthyridine (PubChem CID 156719458) has the molecular formula C15H16ClN3 and a molecular weight of 273.77 g/mol. Its IUPAC name is 7-chloro-2-(1-piperidin-4-ylethenyl)-1,6-naphthyridine.

Molecular Properties

Compound Name7-chloro-2-(1-piperidin-4-ylethenyl)-1,6-naphthyridine
PubChem CID156719458
Molecular FormulaC15H16ClN3
Molecular Weight273.77 g/mol
Exact Mass273.10
IUPAC Name7-chloro-2-(1-piperidin-4-ylethenyl)-1,6-naphthyridine
SMILESC=C(c1ccc2cnc(Cl)cc2n1)C1CCNCC1
InChIInChI=1S/C15H16ClN3/c1-10(11-4-6-17-7-5-11)13-3-2-12-9-18-15(16)8-14(12)19-13/h2-3,8-9,11,17H,1,4-7H2
InChIKeyDNFHQULRJHZGOO-UHFFFAOYSA-N
XLogP3.30
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.77
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

ethyl 2-(7-chloro-1,6-naphthyridin-2-yl)-2-piperidin-4-ylacetate
CID 156719479
7-chloro-N-methyl-N-piperidin-4-ylquinoline-2-carboxamide;dihydrochloride
CID 119442428
4-[1-(4-fluorophenyl)ethenyl]piperidine;hydrochloride
CID 67623256
N-(6-chloro-4-methyl-3-pyridinyl)piperidine-4-carboxamide
CID 113264161
7-chloro-2-(1,4-dioxaspiro[4.5]decan-8-ylmethyl)-1,6-naphthyridine
CID 162439706
4-N-ethenyl-2-fluoro-4-N-(methylideneamino)-1-N-[2-[1-(1-methylpiperidin-4-yl)ethenyl]-1,6-naphthyridin-7-yl]benzene-1,4-diamine
CID 156719511
3-chloro-N-[(3,4-dichlorophenyl)-piperidin-4-ylmethyl]isoquinoline-6-carboxamide
CID 56672409
1-(7-chloro-1,6-naphthyridin-2-yl)-1-(1,4-dioxaspiro[4.5]decan-8-yl)ethanol
CID 166940512
2-chloro-4-piperidin-4-ylpyridine;dihydrochloride
CID 167994882
7-chloro-2-cyclopropylquinazoline
CID 172741252
2-(5-chloro-2,4-difluorophenyl)-6-(1-cyclopropylethenyl)-3-fluoropyridine
CID 169264972
3-bromo-7-chloro-1,6-naphthyridine-2-carboxylic acid
CID 171555659

Frequently Asked Questions

What is the IUPAC name of 7-chloro-2-(1-piperidin-4-ylethenyl)-1,6-naphthyridine?
The IUPAC name of 7-chloro-2-(1-piperidin-4-ylethenyl)-1,6-naphthyridine (CID 156719458) is 7-chloro-2-(1-piperidin-4-ylethenyl)-1,6-naphthyridine.
What is the SMILES notation for 7-chloro-2-(1-piperidin-4-ylethenyl)-1,6-naphthyridine?
The canonical SMILES for 7-chloro-2-(1-piperidin-4-ylethenyl)-1,6-naphthyridine is C=C(c1ccc2cnc(Cl)cc2n1)C1CCNCC1.
What is the InChIKey of 7-chloro-2-(1-piperidin-4-ylethenyl)-1,6-naphthyridine?
The InChIKey is DNFHQULRJHZGOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClN3/c1-10(11-4-6-17-7-5-11)13-3-2-12-9-18-15(16)8-14(12)19-13/h2-3,8-9,11,17H,1,4-7H2.
What are the key properties of 7-chloro-2-(1-piperidin-4-ylethenyl)-1,6-naphthyridine?
7-chloro-2-(1-piperidin-4-ylethenyl)-1,6-naphthyridine has a molecular weight of 273.77 g/mol, XLogP of 3.30, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-2-(1-piperidin-4-ylethenyl)-1,6-naphthyridine is sourced from PubChem (CID 156719458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).