2-amino-N-cyclopentyl-6-ethoxy-N-(2-hydroxyethyl)benzamide

C16H24N2O3 — CID 81396135

IUPAC2-amino-N-cyclopentyl-6-ethoxy-N-(2-hydroxyethyl)benzamide
SMILESCCOc1cccc(N)c1C(=O)N(CCO)C1CCCC1
InChIInChI=1S/C16H24N2O3/c1-2-21-14-9-5-8-13(17)15(14)16(20)18(10-11-19)12-6-3-4-7-12/h5,8-9,12,19H,2-4,6-7,10-11,17H2,1H3
InChIKeyDVRYILDIHOXJIM-UHFFFAOYSA-N
MW292.38 g/mol
LogP2.04
Rot. Bonds6

About 2-amino-N-cyclopentyl-6-ethoxy-N-(2-hydroxyethyl)benzamide

2-amino-N-cyclopentyl-6-ethoxy-N-(2-hydroxyethyl)benzamide (PubChem CID 81396135) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-amino-N-cyclopentyl-6-ethoxy-N-(2-hydroxyethyl)benzamide.

Molecular Properties

Compound Name2-amino-N-cyclopentyl-6-ethoxy-N-(2-hydroxyethyl)benzamide
PubChem CID81396135
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name2-amino-N-cyclopentyl-6-ethoxy-N-(2-hydroxyethyl)benzamide
SMILESCCOc1cccc(N)c1C(=O)N(CCO)C1CCCC1
InChIInChI=1S/C16H24N2O3/c1-2-21-14-9-5-8-13(17)15(14)16(20)18(10-11-19)12-6-3-4-7-12/h5,8-9,12,19H,2-4,6-7,10-11,17H2,1H3
InChIKeyDVRYILDIHOXJIM-UHFFFAOYSA-N
XLogP2.04
TPSA75.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
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

N-cyclopropyl-2-ethoxy-N-(2-hydroxyethyl)-6-nitrobenzamide
CID 81395443
3-amino-N-cyclopentyl-N-(2-hydroxyethyl)-2-methylbenzamide
CID 61115530
2-amino-N-cyclooctyl-6-ethoxybenzamide
CID 81396294
cyclohexylmethyl 2-amino-6-ethoxybenzoate
CID 81414123
(3-ethylcyclohexyl) 2-amino-6-ethoxybenzoate
CID 81396506
2-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-6-methylbenzamide
CID 61114023
N-(2-bromoethyl)-N-cyclopentyl-2-ethoxybenzamide
CID 80659872
methyl 2-amino-6-[[cyclobutyl(2-hydroxyethyl)amino]methyl]benzoate
CID 102860229
N-(2-bromoethyl)-N-cyclohexyl-2-ethoxybenzamide
CID 80652592
2-amino-6-ethoxy-N-(3-hydroxyphenyl)-N-methylbenzamide
CID 107733158
(2-amino-6-ethoxyphenyl)-(2-ethylpiperidin-1-yl)methanone
CID 81420836
2-amino-6-ethoxy-N-methyl-N-(1-methylsulfanylpropan-2-yl)benzamide
CID 112656484

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-cyclopentyl-6-ethoxy-N-(2-hydroxyethyl)benzamide?
The IUPAC name of 2-amino-N-cyclopentyl-6-ethoxy-N-(2-hydroxyethyl)benzamide (CID 81396135) is 2-amino-N-cyclopentyl-6-ethoxy-N-(2-hydroxyethyl)benzamide.
What is the SMILES notation for 2-amino-N-cyclopentyl-6-ethoxy-N-(2-hydroxyethyl)benzamide?
The canonical SMILES for 2-amino-N-cyclopentyl-6-ethoxy-N-(2-hydroxyethyl)benzamide is CCOc1cccc(N)c1C(=O)N(CCO)C1CCCC1.
What is the InChIKey of 2-amino-N-cyclopentyl-6-ethoxy-N-(2-hydroxyethyl)benzamide?
The InChIKey is DVRYILDIHOXJIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-2-21-14-9-5-8-13(17)15(14)16(20)18(10-11-19)12-6-3-4-7-12/h5,8-9,12,19H,2-4,6-7,10-11,17H2,1H3.
What are the key properties of 2-amino-N-cyclopentyl-6-ethoxy-N-(2-hydroxyethyl)benzamide?
2-amino-N-cyclopentyl-6-ethoxy-N-(2-hydroxyethyl)benzamide has a molecular weight of 292.38 g/mol, XLogP of 2.04, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-cyclopentyl-6-ethoxy-N-(2-hydroxyethyl)benzamide is sourced from PubChem (CID 81396135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).