3-[bis(2-hydroxyethyl)amino]-N-phenylbenzamide

C17H20N2O3 — CID 54334365

IUPAC3-[bis(2-hydroxyethyl)amino]-N-phenylbenzamide
SMILESO=C(Nc1ccccc1)c1cccc(N(CCO)CCO)c1
InChIInChI=1S/C17H20N2O3/c20-11-9-19(10-12-21)16-8-4-5-14(13-16)17(22)18-15-6-2-1-3-7-15/h1-8,13,20-21H,9-12H2,(H,18,22)
InChIKeyTUKFCXYDCCMMKO-UHFFFAOYSA-N
MW300.36 g/mol
LogP1.73
Rot. Bonds7

About 3-[bis(2-hydroxyethyl)amino]-N-phenylbenzamide

3-[bis(2-hydroxyethyl)amino]-N-phenylbenzamide (PubChem CID 54334365) has the molecular formula C17H20N2O3 and a molecular weight of 300.36 g/mol. Its IUPAC name is 3-[bis(2-hydroxyethyl)amino]-N-phenylbenzamide.

Molecular Properties

Compound Name3-[bis(2-hydroxyethyl)amino]-N-phenylbenzamide
PubChem CID54334365
Molecular FormulaC17H20N2O3
Molecular Weight300.36 g/mol
Exact Mass300.15
IUPAC Name3-[bis(2-hydroxyethyl)amino]-N-phenylbenzamide
SMILESO=C(Nc1ccccc1)c1cccc(N(CCO)CCO)c1
InChIInChI=1S/C17H20N2O3/c20-11-9-19(10-12-21)16-8-4-5-14(13-16)17(22)18-15-6-2-1-3-7-15/h1-8,13,20-21H,9-12H2,(H,18,22)
InChIKeyTUKFCXYDCCMMKO-UHFFFAOYSA-N
XLogP1.73
TPSA72.80 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 51.73
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 3-[bis(2-hydroxyethyl)amino]-N-phenylbenzamide 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

5-[bis(2-hydroxyethyl)amino]-2-nitro-N-phenylbenzamide
CID 141227765
3-N-methyl-1-N,3-N-diphenylbenzene-1,3-dicarboxamide
CID 109056757
acetic acid;2-[N-(2-hydroxyethyl)anilino]ethanol
CID 22412424
3-[bis(2-hydroxyethyl)amino]-4-ethoxy-N-phenylbenzamide
CID 54008816
2-[N-(2-hydroxyethyl)anilino]ethanol;hydrobromide
CID 21388011
N-[3-[[N-(2-hydroxyethyl)anilino]methyl]phenyl]acetamide
CID 71973103
5-(dipropylamino)-N-phenylpyridine-3-carboxamide
CID 109241022
3-(dipropylamino)-N-quinolin-3-ylbenzamide
CID 66815676
N-[4-(diethylamino)phenyl]-3-(dimethylamino)benzamide
CID 8761945
N-phenyl-3-(sulfanylmethyl)benzamide
CID 18007783
3-[amino-[3-[[3-[amino(phenyl)carbamoyl]benzoyl]amino]phenyl]carbamoyl]-N-phenylbenzamide
CID 123571630
3-(dimethylamino)-N-[3-(hydroxymethyl)phenyl]benzamide
CID 60629966

Frequently Asked Questions

What is the IUPAC name of 3-[bis(2-hydroxyethyl)amino]-N-phenylbenzamide?
The IUPAC name of 3-[bis(2-hydroxyethyl)amino]-N-phenylbenzamide (CID 54334365) is 3-[bis(2-hydroxyethyl)amino]-N-phenylbenzamide.
What is the SMILES notation for 3-[bis(2-hydroxyethyl)amino]-N-phenylbenzamide?
The canonical SMILES for 3-[bis(2-hydroxyethyl)amino]-N-phenylbenzamide is O=C(Nc1ccccc1)c1cccc(N(CCO)CCO)c1.
What is the InChIKey of 3-[bis(2-hydroxyethyl)amino]-N-phenylbenzamide?
The InChIKey is TUKFCXYDCCMMKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3/c20-11-9-19(10-12-21)16-8-4-5-14(13-16)17(22)18-15-6-2-1-3-7-15/h1-8,13,20-21H,9-12H2,(H,18,22).
What are the key properties of 3-[bis(2-hydroxyethyl)amino]-N-phenylbenzamide?
3-[bis(2-hydroxyethyl)amino]-N-phenylbenzamide has a molecular weight of 300.36 g/mol, XLogP of 1.73, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[bis(2-hydroxyethyl)amino]-N-phenylbenzamide is sourced from PubChem (CID 54334365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).