2-anilino-N-(3-methylcyclohexyl)acetamide;hydrochloride

C15H23ClN2O — CID 119716294

IUPAC2-anilino-N-(3-methylcyclohexyl)acetamide;hydrochloride
SMILESCC1CCCC(NC(=O)CNc2ccccc2)C1.Cl
InChIInChI=1S/C15H22N2O.ClH/c1-12-6-5-9-14(10-12)17-15(18)11-16-13-7-3-2-4-8-13;/h2-4,7-8,12,14,16H,5-6,9-11H2,1H3,(H,17,18);1H
InChIKeyWLOSDMKVSWKBEF-UHFFFAOYSA-N
MW282.81 g/mol
LogP3.22
Rot. Bonds4

About 2-anilino-N-(3-methylcyclohexyl)acetamide;hydrochloride

2-anilino-N-(3-methylcyclohexyl)acetamide;hydrochloride (PubChem CID 119716294) has the molecular formula C15H23ClN2O and a molecular weight of 282.81 g/mol. Its IUPAC name is 2-anilino-N-(3-methylcyclohexyl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-anilino-N-(3-methylcyclohexyl)acetamide;hydrochloride
PubChem CID119716294
Molecular FormulaC15H23ClN2O
Molecular Weight282.81 g/mol
Exact Mass282.15
IUPAC Name2-anilino-N-(3-methylcyclohexyl)acetamide;hydrochloride
SMILESCC1CCCC(NC(=O)CNc2ccccc2)C1.Cl
InChIInChI=1S/C15H22N2O.ClH/c1-12-6-5-9-14(10-12)17-15(18)11-16-13-7-3-2-4-8-13;/h2-4,7-8,12,14,16H,5-6,9-11H2,1H3,(H,17,18);1H
InChIKeyWLOSDMKVSWKBEF-UHFFFAOYSA-N
XLogP3.22
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.81
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 103723452
2-anilino-N-(2-methyloxan-4-yl)acetamide
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1-[(1R,3R)-3-methylcyclohexyl]-3-phenylurea
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2-anilino-N-(thian-4-yl)acetamide;hydrochloride
CID 119765688
2-anilino-N-(4-ethylcyclohexyl)acetamide
CID 61470089
3-[(3-methylcyclohexyl)amino]-3-oxopropanoic acid
CID 62229888
2-anilino-N-(1-ethylpiperidin-3-yl)acetamide
CID 61171381
3-(2-hydroxyphenyl)-N-(3-methylcyclohexyl)propanamide
CID 47161541
(2S)-2-amino-N-(3-methylcyclohexyl)-3-phenylpropanamide;hydrochloride
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2-[[(1R,3S)-3-methylcyclohexyl]amino]-1-phenylethanone
CID 122534357
benzyl N-(3-methylcyclohexyl)carbamate
CID 67989254
(2R)-2-amino-N-(3-methylcyclohexyl)-2-phenylacetamide
CID 61156405

Frequently Asked Questions

What is the IUPAC name of 2-anilino-N-(3-methylcyclohexyl)acetamide;hydrochloride?
The IUPAC name of 2-anilino-N-(3-methylcyclohexyl)acetamide;hydrochloride (CID 119716294) is 2-anilino-N-(3-methylcyclohexyl)acetamide;hydrochloride.
What is the SMILES notation for 2-anilino-N-(3-methylcyclohexyl)acetamide;hydrochloride?
The canonical SMILES for 2-anilino-N-(3-methylcyclohexyl)acetamide;hydrochloride is CC1CCCC(NC(=O)CNc2ccccc2)C1.Cl.
What is the InChIKey of 2-anilino-N-(3-methylcyclohexyl)acetamide;hydrochloride?
The InChIKey is WLOSDMKVSWKBEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O.ClH/c1-12-6-5-9-14(10-12)17-15(18)11-16-13-7-3-2-4-8-13;/h2-4,7-8,12,14,16H,5-6,9-11H2,1H3,(H,17,18);1H.
What are the key properties of 2-anilino-N-(3-methylcyclohexyl)acetamide;hydrochloride?
2-anilino-N-(3-methylcyclohexyl)acetamide;hydrochloride has a molecular weight of 282.81 g/mol, XLogP of 3.22, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-N-(3-methylcyclohexyl)acetamide;hydrochloride is sourced from PubChem (CID 119716294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).