4-(2-hydroxyethylamino)-N-(2-phenylethyl)-N-propan-2-ylbenzamide

C20H26N2O2 — CID 174639834

IUPAC4-(2-hydroxyethylamino)-N-(2-phenylethyl)-N-propan-2-ylbenzamide
SMILESCC(C)N(CCc1ccccc1)C(=O)c1ccc(NCCO)cc1
InChIInChI=1S/C20H26N2O2/c1-16(2)22(14-12-17-6-4-3-5-7-17)20(24)18-8-10-19(11-9-18)21-13-15-23/h3-11,16,21,23H,12-15H2,1-2H3
InChIKeyHFLFSBQRVHJOEA-UHFFFAOYSA-N
MW326.44 g/mol
LogP3.18
Rot. Bonds8

About 4-(2-hydroxyethylamino)-N-(2-phenylethyl)-N-propan-2-ylbenzamide

4-(2-hydroxyethylamino)-N-(2-phenylethyl)-N-propan-2-ylbenzamide (PubChem CID 174639834) has the molecular formula C20H26N2O2 and a molecular weight of 326.44 g/mol. Its IUPAC name is 4-(2-hydroxyethylamino)-N-(2-phenylethyl)-N-propan-2-ylbenzamide.

Molecular Properties

Compound Name4-(2-hydroxyethylamino)-N-(2-phenylethyl)-N-propan-2-ylbenzamide
PubChem CID174639834
Molecular FormulaC20H26N2O2
Molecular Weight326.44 g/mol
Exact Mass326.20
IUPAC Name4-(2-hydroxyethylamino)-N-(2-phenylethyl)-N-propan-2-ylbenzamide
SMILESCC(C)N(CCc1ccccc1)C(=O)c1ccc(NCCO)cc1
InChIInChI=1S/C20H26N2O2/c1-16(2)22(14-12-17-6-4-3-5-7-17)20(24)18-8-10-19(11-9-18)21-13-15-23/h3-11,16,21,23H,12-15H2,1-2H3
InChIKeyHFLFSBQRVHJOEA-UHFFFAOYSA-N
XLogP3.18
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-hydroxyethyl)-4-phenyl-N-propan-2-ylbenzamide
CID 43573527
N,N-diethyl-4-(2-phenylethylamino)benzamide
CID 174426094
N-(2-hydroxyethyl)-4-(methanesulfonamido)-N-propan-2-ylbenzamide
CID 43573520
4-N-benzyl-1-N-methyl-1-N-phenyl-4-N-propan-2-ylbenzene-1,4-dicarboxamide
CID 109048603
2,4-dioxo-4-[2-phenylethyl(propan-2-yl)amino]butanoic acid
CID 142214418
3-[propan-2-yl-[4-(3,3,3-trifluoropropyl)benzoyl]amino]propanoic acid
CID 120520159
N-(3-hydroxypropyl)-4-(methanesulfonamido)-N-propan-2-ylbenzamide
CID 61038554
N-benzyl-6-(2-phenylethylamino)-N-propan-2-ylpyridine-3-carboxamide
CID 109158221
methyl 4-(2-phenylethylamino)benzoate
CID 43217242
2-(4-benzylanilino)ethanol
CID 91561467
4-[(2-anilino-2-oxoethyl)sulfonylmethyl]-N-benzyl-N-propan-2-ylbenzamide
CID 39080326
N-methyl-N-[3-(4-methylanilino)propyl]benzamide
CID 14872050

Frequently Asked Questions

What is the IUPAC name of 4-(2-hydroxyethylamino)-N-(2-phenylethyl)-N-propan-2-ylbenzamide?
The IUPAC name of 4-(2-hydroxyethylamino)-N-(2-phenylethyl)-N-propan-2-ylbenzamide (CID 174639834) is 4-(2-hydroxyethylamino)-N-(2-phenylethyl)-N-propan-2-ylbenzamide.
What is the SMILES notation for 4-(2-hydroxyethylamino)-N-(2-phenylethyl)-N-propan-2-ylbenzamide?
The canonical SMILES for 4-(2-hydroxyethylamino)-N-(2-phenylethyl)-N-propan-2-ylbenzamide is CC(C)N(CCc1ccccc1)C(=O)c1ccc(NCCO)cc1.
What is the InChIKey of 4-(2-hydroxyethylamino)-N-(2-phenylethyl)-N-propan-2-ylbenzamide?
The InChIKey is HFLFSBQRVHJOEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O2/c1-16(2)22(14-12-17-6-4-3-5-7-17)20(24)18-8-10-19(11-9-18)21-13-15-23/h3-11,16,21,23H,12-15H2,1-2H3.
What are the key properties of 4-(2-hydroxyethylamino)-N-(2-phenylethyl)-N-propan-2-ylbenzamide?
4-(2-hydroxyethylamino)-N-(2-phenylethyl)-N-propan-2-ylbenzamide has a molecular weight of 326.44 g/mol, XLogP of 3.18, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-hydroxyethylamino)-N-(2-phenylethyl)-N-propan-2-ylbenzamide is sourced from PubChem (CID 174639834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).