N,N-dimethylacetamide;urea

C5H13N3O2 — CID 88522904

IUPACN,N-dimethylacetamide;urea
SMILESCC(=O)N(C)C.NC(N)=O
InChIInChI=1S/C4H9NO.CH4N2O/c1-4(6)5(2)3;2-1(3)4/h1-3H3;(H4,2,3,4)
InChIKeyORSCIKBWIBQCTR-UHFFFAOYSA-N
MW147.18 g/mol
LogP-0.88
Rot. Bonds

About N,N-dimethylacetamide;urea

N,N-dimethylacetamide;urea (PubChem CID 88522904) has the molecular formula C5H13N3O2 and a molecular weight of 147.18 g/mol. Its IUPAC name is N,N-dimethylacetamide;urea.

Molecular Properties

Compound NameN,N-dimethylacetamide;urea
PubChem CID88522904
Molecular FormulaC5H13N3O2
Molecular Weight147.18 g/mol
Exact Mass147.10
IUPAC NameN,N-dimethylacetamide;urea
SMILESCC(=O)N(C)C.NC(N)=O
InChIInChI=1S/C4H9NO.CH4N2O/c1-4(6)5(2)3;2-1(3)4/h1-3H3;(H4,2,3,4)
InChIKeyORSCIKBWIBQCTR-UHFFFAOYSA-N
XLogP-0.88
TPSA89.42 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.18
LogP ≤ 5-0.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethylacetamide;urea?
The IUPAC name of N,N-dimethylacetamide;urea (CID 88522904) is N,N-dimethylacetamide;urea.
What is the SMILES notation for N,N-dimethylacetamide;urea?
The canonical SMILES for N,N-dimethylacetamide;urea is CC(=O)N(C)C.NC(N)=O.
What is the InChIKey of N,N-dimethylacetamide;urea?
The InChIKey is ORSCIKBWIBQCTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO.CH4N2O/c1-4(6)5(2)3;2-1(3)4/h1-3H3;(H4,2,3,4).
What are the key properties of N,N-dimethylacetamide;urea?
N,N-dimethylacetamide;urea has a molecular weight of 147.18 g/mol, XLogP of -0.88, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylacetamide;urea is sourced from PubChem (CID 88522904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).