6-chloro-N-(5,6,7,8-tetrahydro-2,6-naphthyridin-4-yl)-3,4-dihydro-2H-chromene-4-carboxamide

C18H18ClN3O2 — CID 156906877

IUPAC6-chloro-N-(5,6,7,8-tetrahydro-2,6-naphthyridin-4-yl)-3,4-dihydro-2H-chromene-4-carboxamide
SMILESO=C(Nc1cncc2c1CNCC2)C1CCOc2ccc(Cl)cc21
InChIInChI=1S/C18H18ClN3O2/c19-12-1-2-17-14(7-12)13(4-6-24-17)18(23)22-16-10-21-8-11-3-5-20-9-15(11)16/h1-2,7-8,10,13,20H,3-6,9H2,(H,22,23)
InChIKeyMLMSDXNATONIOS-UHFFFAOYSA-N
MW343.81 g/mol
LogP2.89
Rot. Bonds2

About 6-chloro-N-(5,6,7,8-tetrahydro-2,6-naphthyridin-4-yl)-3,4-dihydro-2H-chromene-4-carboxamide

6-chloro-N-(5,6,7,8-tetrahydro-2,6-naphthyridin-4-yl)-3,4-dihydro-2H-chromene-4-carboxamide (PubChem CID 156906877) has the molecular formula C18H18ClN3O2 and a molecular weight of 343.81 g/mol. Its IUPAC name is 6-chloro-N-(5,6,7,8-tetrahydro-2,6-naphthyridin-4-yl)-3,4-dihydro-2H-chromene-4-carboxamide.

Molecular Properties

Compound Name6-chloro-N-(5,6,7,8-tetrahydro-2,6-naphthyridin-4-yl)-3,4-dihydro-2H-chromene-4-carboxamide
PubChem CID156906877
Molecular FormulaC18H18ClN3O2
Molecular Weight343.81 g/mol
Exact Mass343.11
IUPAC Name6-chloro-N-(5,6,7,8-tetrahydro-2,6-naphthyridin-4-yl)-3,4-dihydro-2H-chromene-4-carboxamide
SMILESO=C(Nc1cncc2c1CNCC2)C1CCOc2ccc(Cl)cc21
InChIInChI=1S/C18H18ClN3O2/c19-12-1-2-17-14(7-12)13(4-6-24-17)18(23)22-16-10-21-8-11-3-5-20-9-15(11)16/h1-2,7-8,10,13,20H,3-6,9H2,(H,22,23)
InChIKeyMLMSDXNATONIOS-UHFFFAOYSA-N
XLogP2.89
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.81
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 6-chloro-N-(5,6,7,8-tetrahydro-2,6-naphthyridin-4-yl)-3,4-dihydro-2H-chromene-4-carboxamide with MolForge

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Related Compounds

(4R)-6-chloro-N-(2,6-naphthyridin-4-yl)-3,4-dihydro-2H-chromene-4-carboxamide
CID 156906883
5-chloro-N-isoquinolin-4-yl-2,3-dihydro-1-benzofuran-3-carboxamide
CID 156907081
N-(5-amino-4-methyl-2-pyridinyl)-6-chloro-3,4-dihydro-2H-chromene-4-carboxamide
CID 156906166
6-chloro-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)-3,4-dihydro-2H-chromene-4-carboxamide
CID 156907001
6-chloro-7-fluoro-N-(2,6-naphthyridin-4-yl)-3,4-dihydro-2H-chromene-4-carboxamide
CID 156906287
(4S)-6-chloro-N-isoquinolin-4-yl-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
CID 156906351
6-chloro-3,4-dihydro-2H-chromen-4-ol
CID 15148408
(4R)-6-chloro-N-isoquinolin-4-yl-N-prop-2-enoyl-3,4-dihydro-2H-chromene-4-carboxamide
CID 156907014
(4R)-6-chloro-N-isoquinolin-4-yl-3,4-dihydro-2H-thiochromene-4-carboxamide
CID 169408281
4-chloro-N-(6-chloro-3,4-dihydro-2H-chromen-4-yl)benzamide
CID 108764686
6-chloro-N-[2-(4-pyridin-4-yl-1,3-thiazol-2-yl)ethyl]-3,4-dihydro-2H-chromene-4-carboxamide
CID 166212443
6-chloro-N-isoquinolin-4-yl-3,4-dihydro-1H-isochromene-4-carboxamide
CID 156906879

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(5,6,7,8-tetrahydro-2,6-naphthyridin-4-yl)-3,4-dihydro-2H-chromene-4-carboxamide?
The IUPAC name of 6-chloro-N-(5,6,7,8-tetrahydro-2,6-naphthyridin-4-yl)-3,4-dihydro-2H-chromene-4-carboxamide (CID 156906877) is 6-chloro-N-(5,6,7,8-tetrahydro-2,6-naphthyridin-4-yl)-3,4-dihydro-2H-chromene-4-carboxamide.
What is the SMILES notation for 6-chloro-N-(5,6,7,8-tetrahydro-2,6-naphthyridin-4-yl)-3,4-dihydro-2H-chromene-4-carboxamide?
The canonical SMILES for 6-chloro-N-(5,6,7,8-tetrahydro-2,6-naphthyridin-4-yl)-3,4-dihydro-2H-chromene-4-carboxamide is O=C(Nc1cncc2c1CNCC2)C1CCOc2ccc(Cl)cc21.
What is the InChIKey of 6-chloro-N-(5,6,7,8-tetrahydro-2,6-naphthyridin-4-yl)-3,4-dihydro-2H-chromene-4-carboxamide?
The InChIKey is MLMSDXNATONIOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18ClN3O2/c19-12-1-2-17-14(7-12)13(4-6-24-17)18(23)22-16-10-21-8-11-3-5-20-9-15(11)16/h1-2,7-8,10,13,20H,3-6,9H2,(H,22,23).
What are the key properties of 6-chloro-N-(5,6,7,8-tetrahydro-2,6-naphthyridin-4-yl)-3,4-dihydro-2H-chromene-4-carboxamide?
6-chloro-N-(5,6,7,8-tetrahydro-2,6-naphthyridin-4-yl)-3,4-dihydro-2H-chromene-4-carboxamide has a molecular weight of 343.81 g/mol, XLogP of 2.89, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(5,6,7,8-tetrahydro-2,6-naphthyridin-4-yl)-3,4-dihydro-2H-chromene-4-carboxamide is sourced from PubChem (CID 156906877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).