2-[[2-(hydroxymethyl)cyclohexyl]amino]-N-(3-methoxyphenyl)acetamide

C16H24N2O3 — CID 104696228

IUPAC2-[[2-(hydroxymethyl)cyclohexyl]amino]-N-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(NC(=O)CNC2CCCCC2CO)c1
InChIInChI=1S/C16H24N2O3/c1-21-14-7-4-6-13(9-14)18-16(20)10-17-15-8-3-2-5-12(15)11-19/h4,6-7,9,12,15,17,19H,2-3,5,8,10-11H2,1H3,(H,18,20)
InChIKeyWXTXMYRMHBMTNR-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.77
Rot. Bonds6

About 2-[[2-(hydroxymethyl)cyclohexyl]amino]-N-(3-methoxyphenyl)acetamide

2-[[2-(hydroxymethyl)cyclohexyl]amino]-N-(3-methoxyphenyl)acetamide (PubChem CID 104696228) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-[[2-(hydroxymethyl)cyclohexyl]amino]-N-(3-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[[2-(hydroxymethyl)cyclohexyl]amino]-N-(3-methoxyphenyl)acetamide
PubChem CID104696228
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name2-[[2-(hydroxymethyl)cyclohexyl]amino]-N-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(NC(=O)CNC2CCCCC2CO)c1
InChIInChI=1S/C16H24N2O3/c1-21-14-7-4-6-13(9-14)18-16(20)10-17-15-8-3-2-5-12(15)11-19/h4,6-7,9,12,15,17,19H,2-3,5,8,10-11H2,1H3,(H,18,20)
InChIKeyWXTXMYRMHBMTNR-UHFFFAOYSA-N
XLogP1.77
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 2-[[2-(hydroxymethyl)cyclohexyl]amino]-N-(3-methoxyphenyl)acetamide 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

N-(3-methoxyphenyl)-2-[[(1R,2S)-2-methylcyclohexyl]amino]acetamide
CID 1133388
2-[(2,3-dimethylcyclohexyl)amino]-N-(3-methoxyphenyl)acetamide
CID 43180111
1-[2-(hydroxymethyl)cyclopentyl]-3-(3-methoxyphenyl)urea
CID 103709893
N-(3-methoxyphenyl)-2-[(2-methyloxolan-3-yl)amino]acetamide
CID 82725273
N-[2-(hydroxymethyl)cyclohexyl]-2-(3-methoxyphenyl)acetamide
CID 103798501
2-(hydroxyamino)-N-(3-methoxyphenyl)acetamide
CID 12611733
2-[[(1S)-1-cyclohexylethyl]amino]-N-(3-methoxyphenyl)acetamide
CID 81388783
2-[(2-tert-butylcyclohexyl)amino]-N-[2-(3-methoxyanilino)-2-oxoethyl]-N-methylacetamide
CID 56570222
N-(3-methoxyphenyl)-2-[(2-oxooxolan-3-yl)amino]acetamide
CID 43825760
N-(3-methoxyphenyl)-2-(oxan-2-yl)acetamide
CID 110422002
ethyl 4-[[2-(3-methoxyanilino)-2-oxoethyl]amino]piperidine-1-carboxylate
CID 109003643
3-[[2-(3-methoxyanilino)acetyl]amino]benzamide
CID 54814576

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(hydroxymethyl)cyclohexyl]amino]-N-(3-methoxyphenyl)acetamide?
The IUPAC name of 2-[[2-(hydroxymethyl)cyclohexyl]amino]-N-(3-methoxyphenyl)acetamide (CID 104696228) is 2-[[2-(hydroxymethyl)cyclohexyl]amino]-N-(3-methoxyphenyl)acetamide.
What is the SMILES notation for 2-[[2-(hydroxymethyl)cyclohexyl]amino]-N-(3-methoxyphenyl)acetamide?
The canonical SMILES for 2-[[2-(hydroxymethyl)cyclohexyl]amino]-N-(3-methoxyphenyl)acetamide is COc1cccc(NC(=O)CNC2CCCCC2CO)c1.
What is the InChIKey of 2-[[2-(hydroxymethyl)cyclohexyl]amino]-N-(3-methoxyphenyl)acetamide?
The InChIKey is WXTXMYRMHBMTNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-21-14-7-4-6-13(9-14)18-16(20)10-17-15-8-3-2-5-12(15)11-19/h4,6-7,9,12,15,17,19H,2-3,5,8,10-11H2,1H3,(H,18,20).
What are the key properties of 2-[[2-(hydroxymethyl)cyclohexyl]amino]-N-(3-methoxyphenyl)acetamide?
2-[[2-(hydroxymethyl)cyclohexyl]amino]-N-(3-methoxyphenyl)acetamide has a molecular weight of 292.38 g/mol, XLogP of 1.77, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(hydroxymethyl)cyclohexyl]amino]-N-(3-methoxyphenyl)acetamide is sourced from PubChem (CID 104696228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).