N-ethyl-2-[3-hydroxypropyl(propan-2-yl)amino]-N-(2-methylphenyl)acetamide

C17H28N2O2 — CID 62014625

IUPACN-ethyl-2-[3-hydroxypropyl(propan-2-yl)amino]-N-(2-methylphenyl)acetamide
SMILESCCN(C(=O)CN(CCCO)C(C)C)c1ccccc1C
InChIInChI=1S/C17H28N2O2/c1-5-19(16-10-7-6-9-15(16)4)17(21)13-18(14(2)3)11-8-12-20/h6-7,9-10,14,20H,5,8,11-13H2,1-4H3
InChIKeySRZHAIUFPGNDNO-UHFFFAOYSA-N
MW292.42 g/mol
LogP2.44
Rot. Bonds8

About N-ethyl-2-[3-hydroxypropyl(propan-2-yl)amino]-N-(2-methylphenyl)acetamide

N-ethyl-2-[3-hydroxypropyl(propan-2-yl)amino]-N-(2-methylphenyl)acetamide (PubChem CID 62014625) has the molecular formula C17H28N2O2 and a molecular weight of 292.42 g/mol. Its IUPAC name is N-ethyl-2-[3-hydroxypropyl(propan-2-yl)amino]-N-(2-methylphenyl)acetamide.

Molecular Properties

Compound NameN-ethyl-2-[3-hydroxypropyl(propan-2-yl)amino]-N-(2-methylphenyl)acetamide
PubChem CID62014625
Molecular FormulaC17H28N2O2
Molecular Weight292.42 g/mol
Exact Mass292.22
IUPAC NameN-ethyl-2-[3-hydroxypropyl(propan-2-yl)amino]-N-(2-methylphenyl)acetamide
SMILESCCN(C(=O)CN(CCCO)C(C)C)c1ccccc1C
InChIInChI=1S/C17H28N2O2/c1-5-19(16-10-7-6-9-15(16)4)17(21)13-18(14(2)3)11-8-12-20/h6-7,9-10,14,20H,5,8,11-13H2,1-4H3
InChIKeySRZHAIUFPGNDNO-UHFFFAOYSA-N
XLogP2.44
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.42
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[2-(N-ethyl-2-methylanilino)-2-oxoethyl]-methylamino]propanoic acid
CID 60987713
2-[[2-(N-ethyl-2-methylanilino)-2-oxoethyl]amino]propanoic acid
CID 43467078
2-[[2-(N-ethyl-2-methylanilino)-2-oxoethyl]-methylamino]acetic acid
CID 43442470
methyl 3-[[2-(N-ethyl-2-methylanilino)-2-oxoethyl]-methylamino]propanoate
CID 62013232
N'-ethyl-N'-(2-methylphenyl)-N-propan-2-yloxamide
CID 47332754
2-(1-aminopropan-2-ylsulfanyl)-N-ethyl-N-(2-methylphenyl)acetamide
CID 66220592
3-(N-ethyl-2-methylanilino)-2-methyl-3-oxopropanoic acid
CID 114896860
2-[3-hydroxypropyl(propan-2-yl)amino]-N-methyl-N-[(4-methylphenyl)methyl]acetamide
CID 62013841
N-ethyl-2,2-difluoro-N-(2-methylphenyl)acetamide
CID 103515266
2,2-dichloro-N-ethyl-N-(2-methylphenyl)acetamide
CID 3338024
N-ethyl-N-(2-methylphenyl)-2-(4-methylphenyl)acetamide
CID 3610846
N-ethyl-2-methyl-N-(2-methylphenyl)pentanamide
CID 2890658

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[3-hydroxypropyl(propan-2-yl)amino]-N-(2-methylphenyl)acetamide?
The IUPAC name of N-ethyl-2-[3-hydroxypropyl(propan-2-yl)amino]-N-(2-methylphenyl)acetamide (CID 62014625) is N-ethyl-2-[3-hydroxypropyl(propan-2-yl)amino]-N-(2-methylphenyl)acetamide.
What is the SMILES notation for N-ethyl-2-[3-hydroxypropyl(propan-2-yl)amino]-N-(2-methylphenyl)acetamide?
The canonical SMILES for N-ethyl-2-[3-hydroxypropyl(propan-2-yl)amino]-N-(2-methylphenyl)acetamide is CCN(C(=O)CN(CCCO)C(C)C)c1ccccc1C.
What is the InChIKey of N-ethyl-2-[3-hydroxypropyl(propan-2-yl)amino]-N-(2-methylphenyl)acetamide?
The InChIKey is SRZHAIUFPGNDNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O2/c1-5-19(16-10-7-6-9-15(16)4)17(21)13-18(14(2)3)11-8-12-20/h6-7,9-10,14,20H,5,8,11-13H2,1-4H3.
What are the key properties of N-ethyl-2-[3-hydroxypropyl(propan-2-yl)amino]-N-(2-methylphenyl)acetamide?
N-ethyl-2-[3-hydroxypropyl(propan-2-yl)amino]-N-(2-methylphenyl)acetamide has a molecular weight of 292.42 g/mol, XLogP of 2.44, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[3-hydroxypropyl(propan-2-yl)amino]-N-(2-methylphenyl)acetamide is sourced from PubChem (CID 62014625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).