(1R)-N-naphthalen-2-ylcyclohex-3-ene-1-carboxamide

C17H17NO — CID 8762294

IUPAC(1R)-N-naphthalen-2-ylcyclohex-3-ene-1-carboxamide
SMILESO=C(Nc1ccc2ccccc2c1)[C@H]1CC=CCC1
InChIInChI=1S/C17H17NO/c19-17(14-7-2-1-3-8-14)18-16-11-10-13-6-4-5-9-15(13)12-16/h1-2,4-6,9-12,14H,3,7-8H2,(H,18,19)/t14-/m0/s1
InChIKeyJKHXTTXGRVXTST-AWEZNQCLSA-N
MW251.33 g/mol
LogP4.13
Rot. Bonds2

About (1R)-N-naphthalen-2-ylcyclohex-3-ene-1-carboxamide

(1R)-N-naphthalen-2-ylcyclohex-3-ene-1-carboxamide (PubChem CID 8762294) has the molecular formula C17H17NO and a molecular weight of 251.33 g/mol. Its IUPAC name is (1R)-N-naphthalen-2-ylcyclohex-3-ene-1-carboxamide.

Molecular Properties

Compound Name(1R)-N-naphthalen-2-ylcyclohex-3-ene-1-carboxamide
PubChem CID8762294
Molecular FormulaC17H17NO
Molecular Weight251.33 g/mol
Exact Mass251.13
IUPAC Name(1R)-N-naphthalen-2-ylcyclohex-3-ene-1-carboxamide
SMILESO=C(Nc1ccc2ccccc2c1)[C@H]1CC=CCC1
InChIInChI=1S/C17H17NO/c19-17(14-7-2-1-3-8-14)18-16-11-10-13-6-4-5-9-15(13)12-16/h1-2,4-6,9-12,14H,3,7-8H2,(H,18,19)/t14-/m0/s1
InChIKeyJKHXTTXGRVXTST-AWEZNQCLSA-N
XLogP4.13
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-[4-(cyclohex-3-ene-1-carbonylamino)phenyl]cyclohex-3-ene-1-carboxamide
CID 171577227
(1R)-N-(4-anilinophenyl)cyclohex-3-ene-1-carboxamide
CID 51927414
(1R)-N-(4-phenoxyphenyl)cyclohex-3-ene-1-carboxamide
CID 8780376
(1R)-N-(3,4-dimethylphenyl)cyclohex-3-ene-1-carboxamide
CID 8743787
N-(4-acetamidophenyl)cyclohex-3-ene-1-carboxamide
CID 17394995
4-methyl-N-naphthalen-2-ylcyclohexane-1-carboxamide
CID 775974
N-(4-bromo-3-chlorophenyl)cyclohex-3-ene-1-carboxamide
CID 103824527
N-(4-bromo-3-fluorophenyl)cyclohex-3-ene-1-carboxamide
CID 65430122
4-[[(1S)-cyclohex-3-ene-1-carbonyl]amino]benzamide
CID 8885141
(1S)-N-(3-methylsulfonylphenyl)cyclohex-3-ene-1-carboxamide
CID 26975857
N-(4-cyanophenyl)cyclohex-3-ene-1-carboxamide
CID 42908998
3-amino-N-naphthalen-2-ylcyclohexane-1-carboxamide
CID 63043411

Frequently Asked Questions

What is the IUPAC name of (1R)-N-naphthalen-2-ylcyclohex-3-ene-1-carboxamide?
The IUPAC name of (1R)-N-naphthalen-2-ylcyclohex-3-ene-1-carboxamide (CID 8762294) is (1R)-N-naphthalen-2-ylcyclohex-3-ene-1-carboxamide.
What is the SMILES notation for (1R)-N-naphthalen-2-ylcyclohex-3-ene-1-carboxamide?
The canonical SMILES for (1R)-N-naphthalen-2-ylcyclohex-3-ene-1-carboxamide is O=C(Nc1ccc2ccccc2c1)[C@H]1CC=CCC1.
What is the InChIKey of (1R)-N-naphthalen-2-ylcyclohex-3-ene-1-carboxamide?
The InChIKey is JKHXTTXGRVXTST-AWEZNQCLSA-N. The full InChI is InChI=1S/C17H17NO/c19-17(14-7-2-1-3-8-14)18-16-11-10-13-6-4-5-9-15(13)12-16/h1-2,4-6,9-12,14H,3,7-8H2,(H,18,19)/t14-/m0/s1.
What are the key properties of (1R)-N-naphthalen-2-ylcyclohex-3-ene-1-carboxamide?
(1R)-N-naphthalen-2-ylcyclohex-3-ene-1-carboxamide has a molecular weight of 251.33 g/mol, XLogP of 4.13, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-N-naphthalen-2-ylcyclohex-3-ene-1-carboxamide is sourced from PubChem (CID 8762294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).