2-amino-N,3-dimethyl-N-(2-oxopropyl)butanamide;ethane

C11H24N2O2 — CID 143701294

IUPAC2-amino-N,3-dimethyl-N-(2-oxopropyl)butanamide;ethane
SMILESCC.CC(=O)CN(C)C(=O)C(N)C(C)C
InChIInChI=1S/C9H18N2O2.C2H6/c1-6(2)8(10)9(13)11(4)5-7(3)12;1-2/h6,8H,5,10H2,1-4H3;1-2H3
InChIKeyQNAQIKDCJHQCOH-UHFFFAOYSA-N
MW216.32 g/mol
LogP1.04
Rot. Bonds4

About 2-amino-N,3-dimethyl-N-(2-oxopropyl)butanamide;ethane

2-amino-N,3-dimethyl-N-(2-oxopropyl)butanamide;ethane (PubChem CID 143701294) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 2-amino-N,3-dimethyl-N-(2-oxopropyl)butanamide;ethane.

Molecular Properties

Compound Name2-amino-N,3-dimethyl-N-(2-oxopropyl)butanamide;ethane
PubChem CID143701294
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name2-amino-N,3-dimethyl-N-(2-oxopropyl)butanamide;ethane
SMILESCC.CC(=O)CN(C)C(=O)C(N)C(C)C
InChIInChI=1S/C9H18N2O2.C2H6/c1-6(2)8(10)9(13)11(4)5-7(3)12;1-2/h6,8H,5,10H2,1-4H3;1-2H3
InChIKeyQNAQIKDCJHQCOH-UHFFFAOYSA-N
XLogP1.04
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-N-[2-(dimethylamino)-2-oxoethyl]-N,3-dimethylbutanamide;hydrochloride
CID 119270119
3-amino-4-methylpentan-2-one;1-(dimethylamino)propan-2-one
CID 158014826
2-amino-N,3-dimethyl-N-(2-methylpropyl)butanamide
CID 43272154
2-amino-N,N-bis(2-amino-2-oxoethyl)-3-methylbutanamide
CID 62921574
2-amino-N,3-dimethyl-N-[2-oxo-2-(1-oxopropan-2-ylamino)ethyl]butanamide
CID 123597331
(2S)-2-amino-N-(2-hydroxy-2-methylpropyl)-N,3-dimethylbutanamide
CID 79377276
2-amino-N-[3-(dimethylamino)propyl]-N,3-dimethylbutanamide
CID 63693134
(2R)-2-amino-N-methyl-N-(2-methylprop-2-enyl)propanamide
CID 104868591
(2R)-2-amino-N-(cyclopropylmethyl)-N,3-dimethylbutanamide
CID 79013234
(2S)-2-amino-N-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]-N,3-dimethylbutanamide
CID 61163036
(2R)-2-amino-N-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]-N,3-dimethylbutanamide
CID 79012366
(2S)-2-amino-N-[2-(2-methoxyethylamino)-2-oxoethyl]-N,3-dimethylbutanamide
CID 61164170

Frequently Asked Questions

What is the IUPAC name of 2-amino-N,3-dimethyl-N-(2-oxopropyl)butanamide;ethane?
The IUPAC name of 2-amino-N,3-dimethyl-N-(2-oxopropyl)butanamide;ethane (CID 143701294) is 2-amino-N,3-dimethyl-N-(2-oxopropyl)butanamide;ethane.
What is the SMILES notation for 2-amino-N,3-dimethyl-N-(2-oxopropyl)butanamide;ethane?
The canonical SMILES for 2-amino-N,3-dimethyl-N-(2-oxopropyl)butanamide;ethane is CC.CC(=O)CN(C)C(=O)C(N)C(C)C.
What is the InChIKey of 2-amino-N,3-dimethyl-N-(2-oxopropyl)butanamide;ethane?
The InChIKey is QNAQIKDCJHQCOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2.C2H6/c1-6(2)8(10)9(13)11(4)5-7(3)12;1-2/h6,8H,5,10H2,1-4H3;1-2H3.
What are the key properties of 2-amino-N,3-dimethyl-N-(2-oxopropyl)butanamide;ethane?
2-amino-N,3-dimethyl-N-(2-oxopropyl)butanamide;ethane has a molecular weight of 216.32 g/mol, XLogP of 1.04, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N,3-dimethyl-N-(2-oxopropyl)butanamide;ethane is sourced from PubChem (CID 143701294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).