N-(methylcarbamoyl)butanamide

C6H12N2O2 — CID 12936929

IUPACN-(methylcarbamoyl)butanamide
SMILESCCCC(=O)NC(=O)NC
InChIInChI=1S/C6H12N2O2/c1-3-4-5(9)8-6(10)7-2/h3-4H2,1-2H3,(H2,7,8,9,10)
InChIKeyYRRLCUSJRXHGSD-UHFFFAOYSA-N
MW144.17 g/mol
LogP0.24
Rot. Bonds2

About N-(methylcarbamoyl)butanamide

N-(methylcarbamoyl)butanamide (PubChem CID 12936929) has the molecular formula C6H12N2O2 and a molecular weight of 144.17 g/mol. Its IUPAC name is N-(methylcarbamoyl)butanamide.

Molecular Properties

Compound NameN-(methylcarbamoyl)butanamide
PubChem CID12936929
Molecular FormulaC6H12N2O2
Molecular Weight144.17 g/mol
Exact Mass144.09
IUPAC NameN-(methylcarbamoyl)butanamide
SMILESCCCC(=O)NC(=O)NC
InChIInChI=1S/C6H12N2O2/c1-3-4-5(9)8-6(10)7-2/h3-4H2,1-2H3,(H2,7,8,9,10)
InChIKeyYRRLCUSJRXHGSD-UHFFFAOYSA-N
XLogP0.24
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.17
LogP ≤ 50.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(propylcarbamoyl)butanamide
CID 12936931
3-[[3-(methylcarbamoylamino)-3-oxopropyl]amino]propanoic acid
CID 43466326
N-[4-(methylcarbamoylamino)cyclohexyl]butanamide
CID 166654553
N-but-1-en-2-ylbutanamide
CID 159787043
N-hydroxypropanamide;N-methylbutanamide
CID 158403694
(2S)-2-[3-(methylcarbamoylamino)-3-oxopropoxy]propanoic acid
CID 104876434
4-[methyl-[3-(methylcarbamoylamino)-3-oxopropyl]amino]butanoic acid
CID 55006167
2-[[2-(methylcarbamoylamino)-2-oxoethyl]amino]pentanoic acid
CID 43631818
3-methyl-2-[[3-(methylcarbamoylamino)-3-oxopropyl]amino]butanoic acid
CID 43468682
N-[(4-chlorophenyl)carbamoyl]butanamide
CID 4102985
3-(2,3-dihydroxypropylsulfanyl)-N-(methylcarbamoyl)propanamide
CID 79681774
N-(bromocarbamoyl)pentanamide
CID 101382986

Frequently Asked Questions

What is the IUPAC name of N-(methylcarbamoyl)butanamide?
The IUPAC name of N-(methylcarbamoyl)butanamide (CID 12936929) is N-(methylcarbamoyl)butanamide.
What is the SMILES notation for N-(methylcarbamoyl)butanamide?
The canonical SMILES for N-(methylcarbamoyl)butanamide is CCCC(=O)NC(=O)NC.
What is the InChIKey of N-(methylcarbamoyl)butanamide?
The InChIKey is YRRLCUSJRXHGSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O2/c1-3-4-5(9)8-6(10)7-2/h3-4H2,1-2H3,(H2,7,8,9,10).
What are the key properties of N-(methylcarbamoyl)butanamide?
N-(methylcarbamoyl)butanamide has a molecular weight of 144.17 g/mol, XLogP of 0.24, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(methylcarbamoyl)butanamide is sourced from PubChem (CID 12936929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).