3-(2-hydroxyphenyl)-N-(3-methylcyclohexyl)propanamide

C16H23NO2 — CID 47161541

IUPAC3-(2-hydroxyphenyl)-N-(3-methylcyclohexyl)propanamide
SMILESCC1CCCC(NC(=O)CCc2ccccc2O)C1
InChIInChI=1S/C16H23NO2/c1-12-5-4-7-14(11-12)17-16(19)10-9-13-6-2-3-8-15(13)18/h2-3,6,8,12,14,18H,4-5,7,9-11H2,1H3,(H,17,19)
InChIKeyYKEULWVMDMSPOJ-UHFFFAOYSA-N
MW261.36 g/mol
LogP3.02
Rot. Bonds4

About 3-(2-hydroxyphenyl)-N-(3-methylcyclohexyl)propanamide

3-(2-hydroxyphenyl)-N-(3-methylcyclohexyl)propanamide (PubChem CID 47161541) has the molecular formula C16H23NO2 and a molecular weight of 261.36 g/mol. Its IUPAC name is 3-(2-hydroxyphenyl)-N-(3-methylcyclohexyl)propanamide.

Molecular Properties

Compound Name3-(2-hydroxyphenyl)-N-(3-methylcyclohexyl)propanamide
PubChem CID47161541
Molecular FormulaC16H23NO2
Molecular Weight261.36 g/mol
Exact Mass261.17
IUPAC Name3-(2-hydroxyphenyl)-N-(3-methylcyclohexyl)propanamide
SMILESCC1CCCC(NC(=O)CCc2ccccc2O)C1
InChIInChI=1S/C16H23NO2/c1-12-5-4-7-14(11-12)17-16(19)10-9-13-6-2-3-8-15(13)18/h2-3,6,8,12,14,18H,4-5,7,9-11H2,1H3,(H,17,19)
InChIKeyYKEULWVMDMSPOJ-UHFFFAOYSA-N
XLogP3.02
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.36
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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Ac-YGGFL-NH2
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Frequently Asked Questions

What is the IUPAC name of 3-(2-hydroxyphenyl)-N-(3-methylcyclohexyl)propanamide?
The IUPAC name of 3-(2-hydroxyphenyl)-N-(3-methylcyclohexyl)propanamide (CID 47161541) is 3-(2-hydroxyphenyl)-N-(3-methylcyclohexyl)propanamide.
What is the SMILES notation for 3-(2-hydroxyphenyl)-N-(3-methylcyclohexyl)propanamide?
The canonical SMILES for 3-(2-hydroxyphenyl)-N-(3-methylcyclohexyl)propanamide is CC1CCCC(NC(=O)CCc2ccccc2O)C1.
What is the InChIKey of 3-(2-hydroxyphenyl)-N-(3-methylcyclohexyl)propanamide?
The InChIKey is YKEULWVMDMSPOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO2/c1-12-5-4-7-14(11-12)17-16(19)10-9-13-6-2-3-8-15(13)18/h2-3,6,8,12,14,18H,4-5,7,9-11H2,1H3,(H,17,19).
What are the key properties of 3-(2-hydroxyphenyl)-N-(3-methylcyclohexyl)propanamide?
3-(2-hydroxyphenyl)-N-(3-methylcyclohexyl)propanamide has a molecular weight of 261.36 g/mol, XLogP of 3.02, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-hydroxyphenyl)-N-(3-methylcyclohexyl)propanamide is sourced from PubChem (CID 47161541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).