N,N,2,2-tetraethyl-3-methylbutanamide

C13H27NO — CID 3016602

IUPACN,N,2,2-tetraethyl-3-methylbutanamide
SMILESCCN(CC)C(=O)C(CC)(CC)C(C)C
InChIInChI=1S/C13H27NO/c1-7-13(8-2,11(5)6)12(15)14(9-3)10-4/h11H,7-10H2,1-6H3
InChIKeyDGDSEGJXQRTFBV-UHFFFAOYSA-N
MW213.36 g/mol
LogP3.32
Rot. Bonds6

About N,N,2,2-tetraethyl-3-methylbutanamide

N,N,2,2-tetraethyl-3-methylbutanamide (PubChem CID 3016602) has the molecular formula C13H27NO and a molecular weight of 213.36 g/mol. Its IUPAC name is N,N,2,2-tetraethyl-3-methylbutanamide.

Molecular Properties

Compound NameN,N,2,2-tetraethyl-3-methylbutanamide
PubChem CID3016602
Molecular FormulaC13H27NO
Molecular Weight213.36 g/mol
Exact Mass213.21
IUPAC NameN,N,2,2-tetraethyl-3-methylbutanamide
SMILESCCN(CC)C(=O)C(CC)(CC)C(C)C
InChIInChI=1S/C13H27NO/c1-7-13(8-2,11(5)6)12(15)14(9-3)10-4/h11H,7-10H2,1-6H3
InChIKeyDGDSEGJXQRTFBV-UHFFFAOYSA-N
XLogP3.32
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.36
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,N,2,2-tetraethyl-3-methylbutanamide?
The IUPAC name of N,N,2,2-tetraethyl-3-methylbutanamide (CID 3016602) is N,N,2,2-tetraethyl-3-methylbutanamide.
What is the SMILES notation for N,N,2,2-tetraethyl-3-methylbutanamide?
The canonical SMILES for N,N,2,2-tetraethyl-3-methylbutanamide is CCN(CC)C(=O)C(CC)(CC)C(C)C.
What is the InChIKey of N,N,2,2-tetraethyl-3-methylbutanamide?
The InChIKey is DGDSEGJXQRTFBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO/c1-7-13(8-2,11(5)6)12(15)14(9-3)10-4/h11H,7-10H2,1-6H3.
What are the key properties of N,N,2,2-tetraethyl-3-methylbutanamide?
N,N,2,2-tetraethyl-3-methylbutanamide has a molecular weight of 213.36 g/mol, XLogP of 3.32, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,2,2-tetraethyl-3-methylbutanamide is sourced from PubChem (CID 3016602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).