N-(2-hydroxyethyl)-N-(1-oxo-2,3,4,9-tetrahydrocarbazol-4-yl)benzamide

C21H20N2O3 — CID 10915025

IUPACN-(2-hydroxyethyl)-N-(1-oxo-2,3,4,9-tetrahydrocarbazol-4-yl)benzamide
SMILESO=C1CCC(N(CCO)C(=O)c2ccccc2)c2c1[nH]c1ccccc21
InChIInChI=1S/C21H20N2O3/c24-13-12-23(21(26)14-6-2-1-3-7-14)17-10-11-18(25)20-19(17)15-8-4-5-9-16(15)22-20/h1-9,17,22,24H,10-13H2
InChIKeyLVJQHZYLXVQQMK-UHFFFAOYSA-N
MW348.40 g/mol
LogP3.32
Rot. Bonds4

About N-(2-hydroxyethyl)-N-(1-oxo-2,3,4,9-tetrahydrocarbazol-4-yl)benzamide

N-(2-hydroxyethyl)-N-(1-oxo-2,3,4,9-tetrahydrocarbazol-4-yl)benzamide (PubChem CID 10915025) has the molecular formula C21H20N2O3 and a molecular weight of 348.40 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-N-(1-oxo-2,3,4,9-tetrahydrocarbazol-4-yl)benzamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-N-(1-oxo-2,3,4,9-tetrahydrocarbazol-4-yl)benzamide
PubChem CID10915025
Molecular FormulaC21H20N2O3
Molecular Weight348.40 g/mol
Exact Mass348.15
IUPAC NameN-(2-hydroxyethyl)-N-(1-oxo-2,3,4,9-tetrahydrocarbazol-4-yl)benzamide
SMILESO=C1CCC(N(CCO)C(=O)c2ccccc2)c2c1[nH]c1ccccc21
InChIInChI=1S/C21H20N2O3/c24-13-12-23(21(26)14-6-2-1-3-7-14)17-10-11-18(25)20-19(17)15-8-4-5-9-16(15)22-20/h1-9,17,22,24H,10-13H2
InChIKeyLVJQHZYLXVQQMK-UHFFFAOYSA-N
XLogP3.32
TPSA73.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.40
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

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Related Compounds

N-(2-adamantyl)-N-(2-hydroxyethyl)benzamide
CID 139074714
N-[2-[cyclobutyl(2-hydroxyethyl)amino]-2-oxoethyl]benzamide
CID 102684785
1-N,4-N-dicyclohexyl-1-N,4-N-bis(2-hydroxyethyl)benzene-1,4-dicarboxamide
CID 3317185
(3R,4R)-4-methyl-2,3,4,9-tetrahydro-1H-carbazole-3-carboxylic acid
CID 838888
N-(2-chloroethyl)-N-cyclopropylbenzamide
CID 63394612
3-benzyl-1-(2,3-dihydro-1H-inden-1-yl)-1-(2-hydroxyethyl)urea
CID 111383072
N-[4-[benzoyl(chloromethyl)amino]cyclohexyl]-N-(chloromethyl)benzamide
CID 67251838
3-chloro-N-cyclopropyl-N-(2-hydroxyethyl)benzamide
CID 43576965
N-cyclobutyl-N-(2-hydroxyethyl)-2-phenylcyclopropane-1-carboxamide
CID 102684551
N-(2-amino-2-oxoethyl)-N-piperidin-4-ylbenzamide
CID 60802269
benzoic acid;9H-carbazole
CID 162147282
2-oxo-N-propyl-N-pyrrolidin-3-yl-1H-quinoline-4-carboxamide
CID 119531545

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-N-(1-oxo-2,3,4,9-tetrahydrocarbazol-4-yl)benzamide?
The IUPAC name of N-(2-hydroxyethyl)-N-(1-oxo-2,3,4,9-tetrahydrocarbazol-4-yl)benzamide (CID 10915025) is N-(2-hydroxyethyl)-N-(1-oxo-2,3,4,9-tetrahydrocarbazol-4-yl)benzamide.
What is the SMILES notation for N-(2-hydroxyethyl)-N-(1-oxo-2,3,4,9-tetrahydrocarbazol-4-yl)benzamide?
The canonical SMILES for N-(2-hydroxyethyl)-N-(1-oxo-2,3,4,9-tetrahydrocarbazol-4-yl)benzamide is O=C1CCC(N(CCO)C(=O)c2ccccc2)c2c1[nH]c1ccccc21.
What is the InChIKey of N-(2-hydroxyethyl)-N-(1-oxo-2,3,4,9-tetrahydrocarbazol-4-yl)benzamide?
The InChIKey is LVJQHZYLXVQQMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O3/c24-13-12-23(21(26)14-6-2-1-3-7-14)17-10-11-18(25)20-19(17)15-8-4-5-9-16(15)22-20/h1-9,17,22,24H,10-13H2.
What are the key properties of N-(2-hydroxyethyl)-N-(1-oxo-2,3,4,9-tetrahydrocarbazol-4-yl)benzamide?
N-(2-hydroxyethyl)-N-(1-oxo-2,3,4,9-tetrahydrocarbazol-4-yl)benzamide has a molecular weight of 348.40 g/mol, XLogP of 3.32, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-N-(1-oxo-2,3,4,9-tetrahydrocarbazol-4-yl)benzamide is sourced from PubChem (CID 10915025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).