2-methyl-3-(methylamino)-N-propan-2-ylpropanamide

C8H18N2O — CID 79196226

IUPAC2-methyl-3-(methylamino)-N-propan-2-ylpropanamide
SMILESCNCC(C)C(=O)NC(C)C
InChIInChI=1S/C8H18N2O/c1-6(2)10-8(11)7(3)5-9-4/h6-7,9H,5H2,1-4H3,(H,10,11)
InChIKeyCAVTZUFTCGVYLT-UHFFFAOYSA-N
MW158.24 g/mol
LogP0.37
Rot. Bonds4

About 2-methyl-3-(methylamino)-N-propan-2-ylpropanamide

2-methyl-3-(methylamino)-N-propan-2-ylpropanamide (PubChem CID 79196226) has the molecular formula C8H18N2O and a molecular weight of 158.24 g/mol. Its IUPAC name is 2-methyl-3-(methylamino)-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name2-methyl-3-(methylamino)-N-propan-2-ylpropanamide
PubChem CID79196226
Molecular FormulaC8H18N2O
Molecular Weight158.24 g/mol
Exact Mass158.14
IUPAC Name2-methyl-3-(methylamino)-N-propan-2-ylpropanamide
SMILESCNCC(C)C(=O)NC(C)C
InChIInChI=1S/C8H18N2O/c1-6(2)10-8(11)7(3)5-9-4/h6-7,9H,5H2,1-4H3,(H,10,11)
InChIKeyCAVTZUFTCGVYLT-UHFFFAOYSA-N
XLogP0.37
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-3-(methylamino)-N-(5-methylhexan-2-yl)propanamide
CID 79195498
3-(ethylamino)-2-methyl-N-propan-2-ylpropanamide
CID 62853402
(2S)-3-methyl-2-[[2-methyl-3-(methylamino)propanoyl]amino]butanoic acid
CID 79202638
N-[(1S)-1-cyclohexylethyl]-2-methyl-3-(methylamino)propanamide
CID 81385876
N-(1-cyclopentylethyl)-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119782455
4-methyl-2-[[2-methyl-3-(methylamino)propanoyl]amino]pentanoic acid
CID 79202207
2-methyl-4-oxo-N-propan-2-ylpentanamide
CID 88915731
2-methyl-N-propan-2-ylpentanamide
CID 4628268
N-[1-(diethylamino)propan-2-yl]-2-methyl-3-(methylamino)propanamide
CID 79202231
4-amino-2-[[2-methyl-3-(methylamino)propanoyl]amino]-4-oxobutanoic acid
CID 79202743
4-amino-2-methyl-N-propan-2-ylbutanamide
CID 80541541
3-(dimethylamino)-2-methyl-N-propan-2-ylpropanamide
CID 18678958

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(methylamino)-N-propan-2-ylpropanamide?
The IUPAC name of 2-methyl-3-(methylamino)-N-propan-2-ylpropanamide (CID 79196226) is 2-methyl-3-(methylamino)-N-propan-2-ylpropanamide.
What is the SMILES notation for 2-methyl-3-(methylamino)-N-propan-2-ylpropanamide?
The canonical SMILES for 2-methyl-3-(methylamino)-N-propan-2-ylpropanamide is CNCC(C)C(=O)NC(C)C.
What is the InChIKey of 2-methyl-3-(methylamino)-N-propan-2-ylpropanamide?
The InChIKey is CAVTZUFTCGVYLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O/c1-6(2)10-8(11)7(3)5-9-4/h6-7,9H,5H2,1-4H3,(H,10,11).
What are the key properties of 2-methyl-3-(methylamino)-N-propan-2-ylpropanamide?
2-methyl-3-(methylamino)-N-propan-2-ylpropanamide has a molecular weight of 158.24 g/mol, XLogP of 0.37, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(methylamino)-N-propan-2-ylpropanamide is sourced from PubChem (CID 79196226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).