2-(ethylamino)-N,N,3-trimethylbutanamide

C9H20N2O — CID 143168828

IUPAC2-(ethylamino)-N,N,3-trimethylbutanamide
SMILESCCNC(C(=O)N(C)C)C(C)C
InChIInChI=1S/C9H20N2O/c1-6-10-8(7(2)3)9(12)11(4)5/h7-8,10H,6H2,1-5H3
InChIKeyJGDYLISLJLSFKK-UHFFFAOYSA-N
MW172.27 g/mol
LogP0.71
Rot. Bonds4

About 2-(ethylamino)-N,N,3-trimethylbutanamide

2-(ethylamino)-N,N,3-trimethylbutanamide (PubChem CID 143168828) has the molecular formula C9H20N2O and a molecular weight of 172.27 g/mol. Its IUPAC name is 2-(ethylamino)-N,N,3-trimethylbutanamide.

Molecular Properties

Compound Name2-(ethylamino)-N,N,3-trimethylbutanamide
PubChem CID143168828
Molecular FormulaC9H20N2O
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC Name2-(ethylamino)-N,N,3-trimethylbutanamide
SMILESCCNC(C(=O)N(C)C)C(C)C
InChIInChI=1S/C9H20N2O/c1-6-10-8(7(2)3)9(12)11(4)5/h7-8,10H,6H2,1-5H3
InChIKeyJGDYLISLJLSFKK-UHFFFAOYSA-N
XLogP0.71
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,N,3-trimethyl-2-(2-methylpentan-3-ylamino)butanamide
CID 115711305
2-(1-methoxybutan-2-ylamino)-N,N,3-trimethylbutanamide
CID 115711311
2-(1-methoxypropan-2-ylamino)-N,N,3-trimethylbutanamide
CID 115711313
N,N,3-trimethyl-2-(1H-pyrazol-5-ylmethylamino)butanamide
CID 115607331
N-[1-(dimethylamino)-1-oxopropan-2-yl]-3-(ethylamino)butanamide
CID 62838445
2-(2-hydroxybutylamino)-N,N-dimethylpropanamide
CID 61464462
2-(ethylamino)-3-methyl-N-(2-oxobutyl)butanamide
CID 155432667
(2S)-2-[[(2R)-2-(dimethylamino)-3-methylbutanoyl]amino]-N,N,3-trimethylbutanamide
CID 166777631
(2S,3R)-3-hydroxy-N,N-dimethyl-2-(methylamino)butanamide
CID 163858053
ethane;4-(ethylamino)-5-hydroxyhexan-3-one
CID 167491722
N,N-dimethyl-2-(propylamino)propanamide
CID 43086179
2-[[2-(dimethylamino)-2-oxoethyl]amino]-3-methylbutanoic acid
CID 43468179

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N,N,3-trimethylbutanamide?
The IUPAC name of 2-(ethylamino)-N,N,3-trimethylbutanamide (CID 143168828) is 2-(ethylamino)-N,N,3-trimethylbutanamide.
What is the SMILES notation for 2-(ethylamino)-N,N,3-trimethylbutanamide?
The canonical SMILES for 2-(ethylamino)-N,N,3-trimethylbutanamide is CCNC(C(=O)N(C)C)C(C)C.
What is the InChIKey of 2-(ethylamino)-N,N,3-trimethylbutanamide?
The InChIKey is JGDYLISLJLSFKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O/c1-6-10-8(7(2)3)9(12)11(4)5/h7-8,10H,6H2,1-5H3.
What are the key properties of 2-(ethylamino)-N,N,3-trimethylbutanamide?
2-(ethylamino)-N,N,3-trimethylbutanamide has a molecular weight of 172.27 g/mol, XLogP of 0.71, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N,N,3-trimethylbutanamide is sourced from PubChem (CID 143168828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).