2-amino-N-cyclohexyl-N-(2-hydroxyethyl)-4-methoxybenzamide

C16H24N2O3 — CID 115412770

IUPAC2-amino-N-cyclohexyl-N-(2-hydroxyethyl)-4-methoxybenzamide
SMILESCOc1ccc(C(=O)N(CCO)C2CCCCC2)c(N)c1
InChIInChI=1S/C16H24N2O3/c1-21-13-7-8-14(15(17)11-13)16(20)18(9-10-19)12-5-3-2-4-6-12/h7-8,11-12,19H,2-6,9-10,17H2,1H3
InChIKeyTYRIYPRFXXRWMW-UHFFFAOYSA-N
MW292.38 g/mol
LogP2.04
Rot. Bonds5

About 2-amino-N-cyclohexyl-N-(2-hydroxyethyl)-4-methoxybenzamide

2-amino-N-cyclohexyl-N-(2-hydroxyethyl)-4-methoxybenzamide (PubChem CID 115412770) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-amino-N-cyclohexyl-N-(2-hydroxyethyl)-4-methoxybenzamide.

Molecular Properties

Compound Name2-amino-N-cyclohexyl-N-(2-hydroxyethyl)-4-methoxybenzamide
PubChem CID115412770
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name2-amino-N-cyclohexyl-N-(2-hydroxyethyl)-4-methoxybenzamide
SMILESCOc1ccc(C(=O)N(CCO)C2CCCCC2)c(N)c1
InChIInChI=1S/C16H24N2O3/c1-21-13-7-8-14(15(17)11-13)16(20)18(9-10-19)12-5-3-2-4-6-12/h7-8,11-12,19H,2-6,9-10,17H2,1H3
InChIKeyTYRIYPRFXXRWMW-UHFFFAOYSA-N
XLogP2.04
TPSA75.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-amino-N-cyclobutyl-N-(3-hydroxypropyl)-5-methoxybenzamide
CID 102858713
2-amino-N-cyclohexyl-5-hydroxy-N-(2-hydroxyethyl)benzamide
CID 107074484
N-cyclobutyl-N-(3-hydroxypropyl)-2,5-dimethoxybenzamide
CID 102866390
N-(2-bromoethyl)-N-cyclopentyl-2,4-dimethoxybenzamide
CID 80652711
4-chloro-N-cyclobutyl-N-(2-hydroxyethyl)-2-methoxybenzamide
CID 102867141
N-cyclopentyl-2,4-dihydroxy-N-(2-hydroxyethyl)benzamide
CID 54994498
N-cyclohexyl-4-hydroxy-N-(2-hydroxyethyl)-2-methylbenzamide
CID 107671574
3-amino-N-cyclopentyl-N-(2-hydroxyethyl)-2-methylbenzamide
CID 61115530
2-bromo-N-(2-chloroethyl)-N-cyclopentyl-5-methoxybenzamide
CID 63391871
2-chloro-N-cyclohexyl-N-(2-hydroxyethyl)-4-methylbenzamide
CID 106509715
4-amino-N-cyclobutyl-N-(3-hydroxypropyl)-2-methoxybenzamide
CID 102858749
2-amino-N-cyclopropyl-5-methoxy-N-(3-methylbutyl)benzamide
CID 61105374

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-cyclohexyl-N-(2-hydroxyethyl)-4-methoxybenzamide?
The IUPAC name of 2-amino-N-cyclohexyl-N-(2-hydroxyethyl)-4-methoxybenzamide (CID 115412770) is 2-amino-N-cyclohexyl-N-(2-hydroxyethyl)-4-methoxybenzamide.
What is the SMILES notation for 2-amino-N-cyclohexyl-N-(2-hydroxyethyl)-4-methoxybenzamide?
The canonical SMILES for 2-amino-N-cyclohexyl-N-(2-hydroxyethyl)-4-methoxybenzamide is COc1ccc(C(=O)N(CCO)C2CCCCC2)c(N)c1.
What is the InChIKey of 2-amino-N-cyclohexyl-N-(2-hydroxyethyl)-4-methoxybenzamide?
The InChIKey is TYRIYPRFXXRWMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-21-13-7-8-14(15(17)11-13)16(20)18(9-10-19)12-5-3-2-4-6-12/h7-8,11-12,19H,2-6,9-10,17H2,1H3.
What are the key properties of 2-amino-N-cyclohexyl-N-(2-hydroxyethyl)-4-methoxybenzamide?
2-amino-N-cyclohexyl-N-(2-hydroxyethyl)-4-methoxybenzamide has a molecular weight of 292.38 g/mol, XLogP of 2.04, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-cyclohexyl-N-(2-hydroxyethyl)-4-methoxybenzamide is sourced from PubChem (CID 115412770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).