N-[2-(furan-2-ylmethyl)cyclohexyl]naphthalene-1-carboxamide

C22H23NO2 — CID 593285

IUPACN-[2-(furan-2-ylmethyl)cyclohexyl]naphthalene-1-carboxamide
SMILESO=C(NC1CCCCC1Cc1ccco1)c1cccc2ccccc12
InChIInChI=1S/C22H23NO2/c24-22(20-12-5-9-16-7-1-3-11-19(16)20)23-21-13-4-2-8-17(21)15-18-10-6-14-25-18/h1,3,5-7,9-12,14,17,21H,2,4,8,13,15H2,(H,23,24)
InChIKeyNUCRUAALXFPTSQ-UHFFFAOYSA-N
MW333.43 g/mol
LogP4.96
Rot. Bonds4

About N-[2-(furan-2-ylmethyl)cyclohexyl]naphthalene-1-carboxamide

N-[2-(furan-2-ylmethyl)cyclohexyl]naphthalene-1-carboxamide (PubChem CID 593285) has the molecular formula C22H23NO2 and a molecular weight of 333.43 g/mol. Its IUPAC name is N-[2-(furan-2-ylmethyl)cyclohexyl]naphthalene-1-carboxamide.

Molecular Properties

Compound NameN-[2-(furan-2-ylmethyl)cyclohexyl]naphthalene-1-carboxamide
PubChem CID593285
Molecular FormulaC22H23NO2
Molecular Weight333.43 g/mol
Exact Mass333.17
IUPAC NameN-[2-(furan-2-ylmethyl)cyclohexyl]naphthalene-1-carboxamide
SMILESO=C(NC1CCCCC1Cc1ccco1)c1cccc2ccccc12
InChIInChI=1S/C22H23NO2/c24-22(20-12-5-9-16-7-1-3-11-19(16)20)23-21-13-4-2-8-17(21)15-18-10-6-14-25-18/h1,3,5-7,9-12,14,17,21H,2,4,8,13,15H2,(H,23,24)
InChIKeyNUCRUAALXFPTSQ-UHFFFAOYSA-N
XLogP4.96
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.43
LogP ≤ 54.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-2-ylmethyl)cyclohexyl]naphthalene-1-carboxamide?
The IUPAC name of N-[2-(furan-2-ylmethyl)cyclohexyl]naphthalene-1-carboxamide (CID 593285) is N-[2-(furan-2-ylmethyl)cyclohexyl]naphthalene-1-carboxamide.
What is the SMILES notation for N-[2-(furan-2-ylmethyl)cyclohexyl]naphthalene-1-carboxamide?
The canonical SMILES for N-[2-(furan-2-ylmethyl)cyclohexyl]naphthalene-1-carboxamide is O=C(NC1CCCCC1Cc1ccco1)c1cccc2ccccc12.
What is the InChIKey of N-[2-(furan-2-ylmethyl)cyclohexyl]naphthalene-1-carboxamide?
The InChIKey is NUCRUAALXFPTSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23NO2/c24-22(20-12-5-9-16-7-1-3-11-19(16)20)23-21-13-4-2-8-17(21)15-18-10-6-14-25-18/h1,3,5-7,9-12,14,17,21H,2,4,8,13,15H2,(H,23,24).
What are the key properties of N-[2-(furan-2-ylmethyl)cyclohexyl]naphthalene-1-carboxamide?
N-[2-(furan-2-ylmethyl)cyclohexyl]naphthalene-1-carboxamide has a molecular weight of 333.43 g/mol, XLogP of 4.96, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-2-ylmethyl)cyclohexyl]naphthalene-1-carboxamide is sourced from PubChem (CID 593285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).