N-(2-hydroxypropyl)-N-methylpropanamide;N-methyl-N-(2-oxoethyl)propanamide

C13H26N2O4 — CID 54420661

IUPACN-(2-hydroxypropyl)-N-methylpropanamide;N-methyl-N-(2-oxoethyl)propanamide
SMILESCCC(=O)N(C)CC(C)O.CCC(=O)N(C)CC=O
InChIInChI=1S/C7H15NO2.C6H11NO2/c1-4-7(10)8(3)5-6(2)9;1-3-6(9)7(2)4-5-8/h6,9H,4-5H2,1-3H3;5H,3-4H2,1-2H3
InChIKeyWAOKSJDERWSSJM-UHFFFAOYSA-N
MW274.36 g/mol
LogP0.29
Rot. Bonds6

About N-(2-hydroxypropyl)-N-methylpropanamide;N-methyl-N-(2-oxoethyl)propanamide

N-(2-hydroxypropyl)-N-methylpropanamide;N-methyl-N-(2-oxoethyl)propanamide (PubChem CID 54420661) has the molecular formula C13H26N2O4 and a molecular weight of 274.36 g/mol. Its IUPAC name is N-(2-hydroxypropyl)-N-methylpropanamide;N-methyl-N-(2-oxoethyl)propanamide.

Molecular Properties

Compound NameN-(2-hydroxypropyl)-N-methylpropanamide;N-methyl-N-(2-oxoethyl)propanamide
PubChem CID54420661
Molecular FormulaC13H26N2O4
Molecular Weight274.36 g/mol
Exact Mass274.19
IUPAC NameN-(2-hydroxypropyl)-N-methylpropanamide;N-methyl-N-(2-oxoethyl)propanamide
SMILESCCC(=O)N(C)CC(C)O.CCC(=O)N(C)CC=O
InChIInChI=1S/C7H15NO2.C6H11NO2/c1-4-7(10)8(3)5-6(2)9;1-3-6(9)7(2)4-5-8/h6,9H,4-5H2,1-3H3;5H,3-4H2,1-2H3
InChIKeyWAOKSJDERWSSJM-UHFFFAOYSA-N
XLogP0.29
TPSA77.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

N-(2-hydroxypropyl)-N-methylpropanamide
CID 18720717
N-(2-bromopropyl)-N-methylpropanamide
CID 80665081
N-methyl-N-(2-methylbutyl)propanamide
CID 20674100
N-(2-hydroxypropyl)-N,3,3-trimethylbutanamide
CID 62335118
N-(2-hydroxypropyl)-N-methyl-2-(prop-2-enylamino)acetamide
CID 79280206
N-(2-hydroxypropyl)-N-methyl-3-sulfanylpropanamide
CID 107028266
2-[[2-hydroxypropyl(methyl)carbamoyl]-methylamino]acetic acid
CID 62338542
ethyl N-methyl-N-(2-oxoethyl)carbamate
CID 126971639
2-(1,1-dioxothiolan-3-yl)-N-(2-hydroxypropyl)-N-methylacetamide
CID 62332937
N-(2-hydroxypropyl)-N-methyl-2-piperidin-2-ylacetamide
CID 62336961
N-methyl-N-(2-oxoethyl)acetamide
CID 15885752
1-(2-hydroxypropyl)-1,3,3-trimethylurea
CID 79153852

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxypropyl)-N-methylpropanamide;N-methyl-N-(2-oxoethyl)propanamide?
The IUPAC name of N-(2-hydroxypropyl)-N-methylpropanamide;N-methyl-N-(2-oxoethyl)propanamide (CID 54420661) is N-(2-hydroxypropyl)-N-methylpropanamide;N-methyl-N-(2-oxoethyl)propanamide.
What is the SMILES notation for N-(2-hydroxypropyl)-N-methylpropanamide;N-methyl-N-(2-oxoethyl)propanamide?
The canonical SMILES for N-(2-hydroxypropyl)-N-methylpropanamide;N-methyl-N-(2-oxoethyl)propanamide is CCC(=O)N(C)CC(C)O.CCC(=O)N(C)CC=O.
What is the InChIKey of N-(2-hydroxypropyl)-N-methylpropanamide;N-methyl-N-(2-oxoethyl)propanamide?
The InChIKey is WAOKSJDERWSSJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO2.C6H11NO2/c1-4-7(10)8(3)5-6(2)9;1-3-6(9)7(2)4-5-8/h6,9H,4-5H2,1-3H3;5H,3-4H2,1-2H3.
What are the key properties of N-(2-hydroxypropyl)-N-methylpropanamide;N-methyl-N-(2-oxoethyl)propanamide?
N-(2-hydroxypropyl)-N-methylpropanamide;N-methyl-N-(2-oxoethyl)propanamide has a molecular weight of 274.36 g/mol, XLogP of 0.29, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxypropyl)-N-methylpropanamide;N-methyl-N-(2-oxoethyl)propanamide is sourced from PubChem (CID 54420661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).