N-methyl-N-[1-oxo-1-(propan-2-ylamino)propan-2-yl]butanamide

C11H22N2O2 — CID 59889351

IUPACN-methyl-N-[1-oxo-1-(propan-2-ylamino)propan-2-yl]butanamide
SMILESCCCC(=O)N(C)C(C)C(=O)NC(C)C
InChIInChI=1S/C11H22N2O2/c1-6-7-10(14)13(5)9(4)11(15)12-8(2)3/h8-9H,6-7H2,1-5H3,(H,12,15)
InChIKeyNNWNEWRNFWCDJL-UHFFFAOYSA-N
MW214.31 g/mol
LogP1.16
Rot. Bonds5

About N-methyl-N-[1-oxo-1-(propan-2-ylamino)propan-2-yl]butanamide

N-methyl-N-[1-oxo-1-(propan-2-ylamino)propan-2-yl]butanamide (PubChem CID 59889351) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is N-methyl-N-[1-oxo-1-(propan-2-ylamino)propan-2-yl]butanamide.

Molecular Properties

Compound NameN-methyl-N-[1-oxo-1-(propan-2-ylamino)propan-2-yl]butanamide
PubChem CID59889351
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC NameN-methyl-N-[1-oxo-1-(propan-2-ylamino)propan-2-yl]butanamide
SMILESCCCC(=O)N(C)C(C)C(=O)NC(C)C
InChIInChI=1S/C11H22N2O2/c1-6-7-10(14)13(5)9(4)11(15)12-8(2)3/h8-9H,6-7H2,1-5H3,(H,12,15)
InChIKeyNNWNEWRNFWCDJL-UHFFFAOYSA-N
XLogP1.16
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-benzyl-N-[1-oxo-1-(propan-2-ylamino)propan-2-yl]butanamide
CID 132649959
N-[(2R)-1-oxo-1-(propan-2-ylamino)propan-2-yl]-N-(2-phenylethyl)butanamide
CID 100726790
N-[(2S)-1-oxo-1-(propan-2-ylamino)propan-2-yl]-N-(2-phenylethyl)butanamide
CID 100726781
2-[methyl(pentanoyl)amino]propanoic acid
CID 62627616
ethyl (2R)-2-[3-hydroxypropanoyl(methyl)amino]propanoate
CID 168971565
N-[(3-chlorophenyl)methyl]-N-[1-oxo-1-(propan-2-ylamino)propan-2-yl]butanamide
CID 133239326
ethane;N-propan-2-ylbutanamide
CID 169175258
2-methyl-N-propan-2-ylpentanamide
CID 4628268
(2S)-2-[methyl(octadecanoyl)amino]propanoic acid
CID 20689915
2-[(2-hydroxy-2-methylpropyl)-methylamino]-N-propan-2-ylpropanamide
CID 79390687
2-[heptanoyl(methyl)amino]propanoic acid
CID 62626215
(2S)-2-[[(2S)-2-[butanoyl-[hydroxy(methyl)phosphoryl]amino]propanoyl]amino]propanoic acid
CID 87616364

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[1-oxo-1-(propan-2-ylamino)propan-2-yl]butanamide?
The IUPAC name of N-methyl-N-[1-oxo-1-(propan-2-ylamino)propan-2-yl]butanamide (CID 59889351) is N-methyl-N-[1-oxo-1-(propan-2-ylamino)propan-2-yl]butanamide.
What is the SMILES notation for N-methyl-N-[1-oxo-1-(propan-2-ylamino)propan-2-yl]butanamide?
The canonical SMILES for N-methyl-N-[1-oxo-1-(propan-2-ylamino)propan-2-yl]butanamide is CCCC(=O)N(C)C(C)C(=O)NC(C)C.
What is the InChIKey of N-methyl-N-[1-oxo-1-(propan-2-ylamino)propan-2-yl]butanamide?
The InChIKey is NNWNEWRNFWCDJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-6-7-10(14)13(5)9(4)11(15)12-8(2)3/h8-9H,6-7H2,1-5H3,(H,12,15).
What are the key properties of N-methyl-N-[1-oxo-1-(propan-2-ylamino)propan-2-yl]butanamide?
N-methyl-N-[1-oxo-1-(propan-2-ylamino)propan-2-yl]butanamide has a molecular weight of 214.31 g/mol, XLogP of 1.16, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[1-oxo-1-(propan-2-ylamino)propan-2-yl]butanamide is sourced from PubChem (CID 59889351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).