N-(2-cyclohexyl-2-hydroxyethyl)naphthalene-1-carboxamide

C19H23NO2 — CID 56764294

IUPACN-(2-cyclohexyl-2-hydroxyethyl)naphthalene-1-carboxamide
SMILESO=C(NCC(O)C1CCCCC1)c1cccc2ccccc12
InChIInChI=1S/C19H23NO2/c21-18(15-8-2-1-3-9-15)13-20-19(22)17-12-6-10-14-7-4-5-11-16(14)17/h4-7,10-12,15,18,21H,1-3,8-9,13H2,(H,20,22)
InChIKeyJVEDAFLPQZWZGG-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.51
Rot. Bonds4

About N-(2-cyclohexyl-2-hydroxyethyl)naphthalene-1-carboxamide

N-(2-cyclohexyl-2-hydroxyethyl)naphthalene-1-carboxamide (PubChem CID 56764294) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is N-(2-cyclohexyl-2-hydroxyethyl)naphthalene-1-carboxamide.

Molecular Properties

Compound NameN-(2-cyclohexyl-2-hydroxyethyl)naphthalene-1-carboxamide
PubChem CID56764294
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC NameN-(2-cyclohexyl-2-hydroxyethyl)naphthalene-1-carboxamide
SMILESO=C(NCC(O)C1CCCCC1)c1cccc2ccccc12
InChIInChI=1S/C19H23NO2/c21-18(15-8-2-1-3-9-15)13-20-19(22)17-12-6-10-14-7-4-5-11-16(14)17/h4-7,10-12,15,18,21H,1-3,8-9,13H2,(H,20,22)
InChIKeyJVEDAFLPQZWZGG-UHFFFAOYSA-N
XLogP3.51
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexyl-2-hydroxyethyl)naphthalene-1-carboxamide?
The IUPAC name of N-(2-cyclohexyl-2-hydroxyethyl)naphthalene-1-carboxamide (CID 56764294) is N-(2-cyclohexyl-2-hydroxyethyl)naphthalene-1-carboxamide.
What is the SMILES notation for N-(2-cyclohexyl-2-hydroxyethyl)naphthalene-1-carboxamide?
The canonical SMILES for N-(2-cyclohexyl-2-hydroxyethyl)naphthalene-1-carboxamide is O=C(NCC(O)C1CCCCC1)c1cccc2ccccc12.
What is the InChIKey of N-(2-cyclohexyl-2-hydroxyethyl)naphthalene-1-carboxamide?
The InChIKey is JVEDAFLPQZWZGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c21-18(15-8-2-1-3-9-15)13-20-19(22)17-12-6-10-14-7-4-5-11-16(14)17/h4-7,10-12,15,18,21H,1-3,8-9,13H2,(H,20,22).
What are the key properties of N-(2-cyclohexyl-2-hydroxyethyl)naphthalene-1-carboxamide?
N-(2-cyclohexyl-2-hydroxyethyl)naphthalene-1-carboxamide has a molecular weight of 297.40 g/mol, XLogP of 3.51, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexyl-2-hydroxyethyl)naphthalene-1-carboxamide is sourced from PubChem (CID 56764294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).