2-(ethylamino)-N-(2-hydroxyethyl)-N-pentan-3-ylbenzamide

C16H26N2O2 — CID 62175910

IUPAC2-(ethylamino)-N-(2-hydroxyethyl)-N-pentan-3-ylbenzamide
SMILESCCNc1ccccc1C(=O)N(CCO)C(CC)CC
InChIInChI=1S/C16H26N2O2/c1-4-13(5-2)18(11-12-19)16(20)14-9-7-8-10-15(14)17-6-3/h7-10,13,17,19H,4-6,11-12H2,1-3H3
InChIKeyYOBHKRJOHGCNJO-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.74
Rot. Bonds8

About 2-(ethylamino)-N-(2-hydroxyethyl)-N-pentan-3-ylbenzamide

2-(ethylamino)-N-(2-hydroxyethyl)-N-pentan-3-ylbenzamide (PubChem CID 62175910) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 2-(ethylamino)-N-(2-hydroxyethyl)-N-pentan-3-ylbenzamide.

Molecular Properties

Compound Name2-(ethylamino)-N-(2-hydroxyethyl)-N-pentan-3-ylbenzamide
PubChem CID62175910
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC Name2-(ethylamino)-N-(2-hydroxyethyl)-N-pentan-3-ylbenzamide
SMILESCCNc1ccccc1C(=O)N(CCO)C(CC)CC
InChIInChI=1S/C16H26N2O2/c1-4-13(5-2)18(11-12-19)16(20)14-9-7-8-10-15(14)17-6-3/h7-10,13,17,19H,4-6,11-12H2,1-3H3
InChIKeyYOBHKRJOHGCNJO-UHFFFAOYSA-N
XLogP2.74
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-hydrazinyl-N-(2-methoxyethyl)-N-pentan-3-ylbenzamide
CID 62243860
N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-(ethylamino)benzamide
CID 103190086
2-(ethylamino)-N-methyl-N-(3-methylbutyl)benzamide
CID 62177256
2-(ethylamino)-N-methyl-N-(2-phenylethyl)benzamide
CID 63108183
N-[2-(dimethylamino)-2-oxoethyl]-2-(ethylamino)-N-methylbenzamide
CID 55176895
5-fluoro-N-(2-hydroxyethyl)-2-methyl-N-pentan-3-ylbenzamide
CID 63049149
2-chloro-N-(2-hydroxyethyl)-3-nitro-N-pentan-3-ylbenzamide
CID 115931134
N-(2-hydroxyethyl)-4-methyl-N-pentan-3-ylthiophene-3-carboxamide
CID 79808703
N-(2-hydroxyethyl)-4-(methylamino)-N-pentan-3-ylbenzamide
CID 62175742
2-(ethylamino)-N-(2-methylpropyl)-N-pentan-3-ylpyridine-3-carboxamide
CID 79487895
N-(2-chloroethyl)-2-fluoro-N-pentan-3-ylbenzamide
CID 55185541
[2-(ethylamino)phenyl]-phenylmethanone
CID 3661027

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-(2-hydroxyethyl)-N-pentan-3-ylbenzamide?
The IUPAC name of 2-(ethylamino)-N-(2-hydroxyethyl)-N-pentan-3-ylbenzamide (CID 62175910) is 2-(ethylamino)-N-(2-hydroxyethyl)-N-pentan-3-ylbenzamide.
What is the SMILES notation for 2-(ethylamino)-N-(2-hydroxyethyl)-N-pentan-3-ylbenzamide?
The canonical SMILES for 2-(ethylamino)-N-(2-hydroxyethyl)-N-pentan-3-ylbenzamide is CCNc1ccccc1C(=O)N(CCO)C(CC)CC.
What is the InChIKey of 2-(ethylamino)-N-(2-hydroxyethyl)-N-pentan-3-ylbenzamide?
The InChIKey is YOBHKRJOHGCNJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-4-13(5-2)18(11-12-19)16(20)14-9-7-8-10-15(14)17-6-3/h7-10,13,17,19H,4-6,11-12H2,1-3H3.
What are the key properties of 2-(ethylamino)-N-(2-hydroxyethyl)-N-pentan-3-ylbenzamide?
2-(ethylamino)-N-(2-hydroxyethyl)-N-pentan-3-ylbenzamide has a molecular weight of 278.40 g/mol, XLogP of 2.74, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-(2-hydroxyethyl)-N-pentan-3-ylbenzamide is sourced from PubChem (CID 62175910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).