N-(1,3-benzoxazol-2-ylmethyl)cyclohexanecarboxamide

C15H18N2O2 — CID 110711622

IUPACN-(1,3-benzoxazol-2-ylmethyl)cyclohexanecarboxamide
SMILESO=C(NCc1nc2ccccc2o1)C1CCCCC1
InChIInChI=1S/C15H18N2O2/c18-15(11-6-2-1-3-7-11)16-10-14-17-12-8-4-5-9-13(12)19-14/h4-5,8-9,11H,1-3,6-7,10H2,(H,16,18)
InChIKeyJFTPIHVUNJPLRB-UHFFFAOYSA-N
MW258.32 g/mol
LogP3.02
Rot. Bonds3

About N-(1,3-benzoxazol-2-ylmethyl)cyclohexanecarboxamide

N-(1,3-benzoxazol-2-ylmethyl)cyclohexanecarboxamide (PubChem CID 110711622) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is N-(1,3-benzoxazol-2-ylmethyl)cyclohexanecarboxamide.

Molecular Properties

Compound NameN-(1,3-benzoxazol-2-ylmethyl)cyclohexanecarboxamide
PubChem CID110711622
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC NameN-(1,3-benzoxazol-2-ylmethyl)cyclohexanecarboxamide
SMILESO=C(NCc1nc2ccccc2o1)C1CCCCC1
InChIInChI=1S/C15H18N2O2/c18-15(11-6-2-1-3-7-11)16-10-14-17-12-8-4-5-9-13(12)19-14/h4-5,8-9,11H,1-3,6-7,10H2,(H,16,18)
InChIKeyJFTPIHVUNJPLRB-UHFFFAOYSA-N
XLogP3.02
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(1,3-benzoxazol-2-ylmethyl)cyclohexanecarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(1,3-benzoxazol-2-ylmethyl)-3-cyclohexylurea
CID 110747198
N-(1,3-benzoxazol-2-ylmethyl)-2-cyclopent-2-en-1-ylacetamide
CID 91761912
N-[2-(1,3-benzoxazol-2-yl)ethyl]-1-methylpiperidine-3-carboxamide
CID 91766973
N-[1-(1,3-benzoxazol-2-yl)ethyl]cyclohexanecarboxamide
CID 110278943
2-(1,3-benzoxazol-2-yl)-N-[(1S,2S)-2-hydroxycyclooctyl]acetamide
CID 146038837
N-(1,3-benzoxazol-2-ylmethyl)-3,3-dimethylbutanamide
CID 110711685
N-[4-(1,3-benzoxazol-2-yl)phenyl]cyclohexanecarboxamide
CID 777186
[4-(1,3-benzoxazol-2-ylmethyl)piperazin-1-yl]-cyclopentylmethanone
CID 36880399
1-(1,3-benzoxazol-2-yl)-N-benzylpiperidine-3-carboxamide
CID 3622789
1-(1,3-benzoxazol-2-yl)-N-[2-(cycloheptylamino)ethyl]piperidine-4-carboxamide
CID 119620972
N-(1,3-benzoxazol-2-ylmethyl)-2-(3-methylpiperidin-1-yl)acetamide
CID 91792073
N-[2-(1,3-benzoxazol-2-yl)ethyl]-1-propanoylpiperidine-4-carboxamide
CID 118764984

Frequently Asked Questions

What is the IUPAC name of N-(1,3-benzoxazol-2-ylmethyl)cyclohexanecarboxamide?
The IUPAC name of N-(1,3-benzoxazol-2-ylmethyl)cyclohexanecarboxamide (CID 110711622) is N-(1,3-benzoxazol-2-ylmethyl)cyclohexanecarboxamide.
What is the SMILES notation for N-(1,3-benzoxazol-2-ylmethyl)cyclohexanecarboxamide?
The canonical SMILES for N-(1,3-benzoxazol-2-ylmethyl)cyclohexanecarboxamide is O=C(NCc1nc2ccccc2o1)C1CCCCC1.
What is the InChIKey of N-(1,3-benzoxazol-2-ylmethyl)cyclohexanecarboxamide?
The InChIKey is JFTPIHVUNJPLRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c18-15(11-6-2-1-3-7-11)16-10-14-17-12-8-4-5-9-13(12)19-14/h4-5,8-9,11H,1-3,6-7,10H2,(H,16,18).
What are the key properties of N-(1,3-benzoxazol-2-ylmethyl)cyclohexanecarboxamide?
N-(1,3-benzoxazol-2-ylmethyl)cyclohexanecarboxamide has a molecular weight of 258.32 g/mol, XLogP of 3.02, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-benzoxazol-2-ylmethyl)cyclohexanecarboxamide is sourced from PubChem (CID 110711622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).