N,N-dibutyl-3,3-dimethylbutanamide

C14H29NO — CID 2169365

IUPACN,N-dibutyl-3,3-dimethylbutanamide
SMILESCCCCN(CCCC)C(=O)CC(C)(C)C
InChIInChI=1S/C14H29NO/c1-6-8-10-15(11-9-7-2)13(16)12-14(3,4)5/h6-12H2,1-5H3
InChIKeyVKKCXSJCZAHXIY-UHFFFAOYSA-N
MW227.39 g/mol
LogP3.85
Rot. Bonds7

About N,N-dibutyl-3,3-dimethylbutanamide

N,N-dibutyl-3,3-dimethylbutanamide (PubChem CID 2169365) has the molecular formula C14H29NO and a molecular weight of 227.39 g/mol. Its IUPAC name is N,N-dibutyl-3,3-dimethylbutanamide.

Molecular Properties

Compound NameN,N-dibutyl-3,3-dimethylbutanamide
PubChem CID2169365
Molecular FormulaC14H29NO
Molecular Weight227.39 g/mol
Exact Mass227.22
IUPAC NameN,N-dibutyl-3,3-dimethylbutanamide
SMILESCCCCN(CCCC)C(=O)CC(C)(C)C
InChIInChI=1S/C14H29NO/c1-6-8-10-15(11-9-7-2)13(16)12-14(3,4)5/h6-12H2,1-5H3
InChIKeyVKKCXSJCZAHXIY-UHFFFAOYSA-N
XLogP3.85
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.39
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,N-dibutyl-3,3-dimethylbutanamide?
The IUPAC name of N,N-dibutyl-3,3-dimethylbutanamide (CID 2169365) is N,N-dibutyl-3,3-dimethylbutanamide.
What is the SMILES notation for N,N-dibutyl-3,3-dimethylbutanamide?
The canonical SMILES for N,N-dibutyl-3,3-dimethylbutanamide is CCCCN(CCCC)C(=O)CC(C)(C)C.
What is the InChIKey of N,N-dibutyl-3,3-dimethylbutanamide?
The InChIKey is VKKCXSJCZAHXIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO/c1-6-8-10-15(11-9-7-2)13(16)12-14(3,4)5/h6-12H2,1-5H3.
What are the key properties of N,N-dibutyl-3,3-dimethylbutanamide?
N,N-dibutyl-3,3-dimethylbutanamide has a molecular weight of 227.39 g/mol, XLogP of 3.85, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibutyl-3,3-dimethylbutanamide is sourced from PubChem (CID 2169365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).