6-chloro-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]-2H-chromene-3-carboxamide

C20H18ClNO2 — CID 6930468

IUPAC6-chloro-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]-2H-chromene-3-carboxamide
SMILESO=C(N[C@H]1CCCc2ccccc21)C1=Cc2cc(Cl)ccc2OC1
InChIInChI=1S/C20H18ClNO2/c21-16-8-9-19-14(11-16)10-15(12-24-19)20(23)22-18-7-3-5-13-4-1-2-6-17(13)18/h1-2,4,6,8-11,18H,3,5,7,12H2,(H,22,23)/t18-/m0/s1
InChIKeyGPFMCKVYKVDOBZ-SFHVURJKSA-N
MW339.82 g/mol
LogP4.31
Rot. Bonds2

About 6-chloro-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]-2H-chromene-3-carboxamide

6-chloro-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]-2H-chromene-3-carboxamide (PubChem CID 6930468) has the molecular formula C20H18ClNO2 and a molecular weight of 339.82 g/mol. Its IUPAC name is 6-chloro-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]-2H-chromene-3-carboxamide.

Molecular Properties

Compound Name6-chloro-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]-2H-chromene-3-carboxamide
PubChem CID6930468
Molecular FormulaC20H18ClNO2
Molecular Weight339.82 g/mol
Exact Mass339.10
IUPAC Name6-chloro-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]-2H-chromene-3-carboxamide
SMILESO=C(N[C@H]1CCCc2ccccc21)C1=Cc2cc(Cl)ccc2OC1
InChIInChI=1S/C20H18ClNO2/c21-16-8-9-19-14(11-16)10-15(12-24-19)20(23)22-18-7-3-5-13-4-1-2-6-17(13)18/h1-2,4,6,8-11,18H,3,5,7,12H2,(H,22,23)/t18-/m0/s1
InChIKeyGPFMCKVYKVDOBZ-SFHVURJKSA-N
XLogP4.31
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.82
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,5-dichloro-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide
CID 2124760
2,5-difluoro-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide
CID 27184099
4-chloro-2-nitro-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide
CID 9216819
3,5-dichloro-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide
CID 7428902
5-chloro-2-nitro-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide
CID 2654690
6-chloro-N-pyrrolidin-3-yl-2H-chromene-3-carboxamide;hydrochloride
CID 119454003
2-chloro-4-fluoro-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
CID 42989247
2,5-dimethyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide
CID 7919785
2,4-dichloro-N-[2-oxo-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)ethyl]benzamide
CID 46520269
2-(3-aminopropoxy)-4-chloro-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide
CID 125171601
2-(4-chloro-2-fluorophenyl)-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
CID 100671726
N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]naphthalene-2-carboxamide
CID 7688440

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]-2H-chromene-3-carboxamide?
The IUPAC name of 6-chloro-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]-2H-chromene-3-carboxamide (CID 6930468) is 6-chloro-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]-2H-chromene-3-carboxamide.
What is the SMILES notation for 6-chloro-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]-2H-chromene-3-carboxamide?
The canonical SMILES for 6-chloro-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]-2H-chromene-3-carboxamide is O=C(N[C@H]1CCCc2ccccc21)C1=Cc2cc(Cl)ccc2OC1.
What is the InChIKey of 6-chloro-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]-2H-chromene-3-carboxamide?
The InChIKey is GPFMCKVYKVDOBZ-SFHVURJKSA-N. The full InChI is InChI=1S/C20H18ClNO2/c21-16-8-9-19-14(11-16)10-15(12-24-19)20(23)22-18-7-3-5-13-4-1-2-6-17(13)18/h1-2,4,6,8-11,18H,3,5,7,12H2,(H,22,23)/t18-/m0/s1.
What are the key properties of 6-chloro-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]-2H-chromene-3-carboxamide?
6-chloro-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]-2H-chromene-3-carboxamide has a molecular weight of 339.82 g/mol, XLogP of 4.31, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]-2H-chromene-3-carboxamide is sourced from PubChem (CID 6930468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).