N,N,3,4,4-pentamethylpentanamide

C10H21NO — CID 3780256

IUPACN,N,3,4,4-pentamethylpentanamide
SMILESCC(CC(=O)N(C)C)C(C)(C)C
InChIInChI=1S/C10H21NO/c1-8(10(2,3)4)7-9(12)11(5)6/h8H,7H2,1-6H3
InChIKeyYMUNKAWYPKXSSN-UHFFFAOYSA-N
MW171.28 g/mol
LogP2.15
Rot. Bonds2

About N,N,3,4,4-pentamethylpentanamide

N,N,3,4,4-pentamethylpentanamide (PubChem CID 3780256) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is N,N,3,4,4-pentamethylpentanamide.

Molecular Properties

Compound NameN,N,3,4,4-pentamethylpentanamide
PubChem CID3780256
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC NameN,N,3,4,4-pentamethylpentanamide
SMILESCC(CC(=O)N(C)C)C(C)(C)C
InChIInChI=1S/C10H21NO/c1-8(10(2,3)4)7-9(12)11(5)6/h8H,7H2,1-6H3
InChIKeyYMUNKAWYPKXSSN-UHFFFAOYSA-N
XLogP2.15
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,N,3,4,4-pentamethylpentanamide?
The IUPAC name of N,N,3,4,4-pentamethylpentanamide (CID 3780256) is N,N,3,4,4-pentamethylpentanamide.
What is the SMILES notation for N,N,3,4,4-pentamethylpentanamide?
The canonical SMILES for N,N,3,4,4-pentamethylpentanamide is CC(CC(=O)N(C)C)C(C)(C)C.
What is the InChIKey of N,N,3,4,4-pentamethylpentanamide?
The InChIKey is YMUNKAWYPKXSSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-8(10(2,3)4)7-9(12)11(5)6/h8H,7H2,1-6H3.
What are the key properties of N,N,3,4,4-pentamethylpentanamide?
N,N,3,4,4-pentamethylpentanamide has a molecular weight of 171.28 g/mol, XLogP of 2.15, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,3,4,4-pentamethylpentanamide is sourced from PubChem (CID 3780256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).