N,N,N',N',2-pentamethylhexanediamide

C11H22N2O2 — CID 12572189

IUPACN,N,N',N',2-pentamethylhexanediamide
SMILESCC(CCCC(=O)N(C)C)C(=O)N(C)C
InChIInChI=1S/C11H22N2O2/c1-9(11(15)13(4)5)7-6-8-10(14)12(2)3/h9H,6-8H2,1-5H3
InChIKeyCECZFEHKURLFJH-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.97
Rot. Bonds5

About N,N,N',N',2-pentamethylhexanediamide

N,N,N',N',2-pentamethylhexanediamide (PubChem CID 12572189) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is N,N,N',N',2-pentamethylhexanediamide.

Molecular Properties

Compound NameN,N,N',N',2-pentamethylhexanediamide
PubChem CID12572189
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC NameN,N,N',N',2-pentamethylhexanediamide
SMILESCC(CCCC(=O)N(C)C)C(=O)N(C)C
InChIInChI=1S/C11H22N2O2/c1-9(11(15)13(4)5)7-6-8-10(14)12(2)3/h9H,6-8H2,1-5H3
InChIKeyCECZFEHKURLFJH-UHFFFAOYSA-N
XLogP0.97
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-Dimethylhexanamide
CID 22084
N1,N1,N6,N6-Tetramethylhexanediamide
CID 94791
N~1~,N~1~,N~7~,N~7~-Tetramethylheptanediamide
CID 169625
Valeramide, N,N-dimethyl-2-propyl-
CID 211206
N,N-Dimethylcyclopentanecarboxamide
CID 550256
N,N,2-trimethyloctanamide
CID 87943776
Cyclohexane-1,4-cis-dicarboxamide, N,N,N',N'-tetramethyl-
CID 551854
2-ethyl-N,N-dimethylhexanamide
CID 3019000
N,N,2-trimethylpentanamide
CID 4477108
N,N,3-trimethylpentanamide
CID 85290591
Cyclopentane-cis-1,3-dicarboxamide, N,N,N',N'-tetramethyl-
CID 551780
Pentanamide, N,N,3-trimethyl-, (3S)-
CID 10855582

Frequently Asked Questions

What is the IUPAC name of N,N,N',N',2-pentamethylhexanediamide?
The IUPAC name of N,N,N',N',2-pentamethylhexanediamide (CID 12572189) is N,N,N',N',2-pentamethylhexanediamide.
What is the SMILES notation for N,N,N',N',2-pentamethylhexanediamide?
The canonical SMILES for N,N,N',N',2-pentamethylhexanediamide is CC(CCCC(=O)N(C)C)C(=O)N(C)C.
What is the InChIKey of N,N,N',N',2-pentamethylhexanediamide?
The InChIKey is CECZFEHKURLFJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-9(11(15)13(4)5)7-6-8-10(14)12(2)3/h9H,6-8H2,1-5H3.
What are the key properties of N,N,N',N',2-pentamethylhexanediamide?
N,N,N',N',2-pentamethylhexanediamide has a molecular weight of 214.31 g/mol, XLogP of 0.97, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,N',N',2-pentamethylhexanediamide is sourced from PubChem (CID 12572189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).