N,2-dimethyl-N-(3-methylbutyl)propanamide

C10H21NO — CID 60738277

IUPACN,2-dimethyl-N-(3-methylbutyl)propanamide
SMILESCC(C)CCN(C)C(=O)C(C)C
InChIInChI=1S/C10H21NO/c1-8(2)6-7-11(5)10(12)9(3)4/h8-9H,6-7H2,1-5H3
InChIKeyZZNHIYKQNFDDGB-UHFFFAOYSA-N
MW171.28 g/mol
LogP2.15
Rot. Bonds4

About N,2-dimethyl-N-(3-methylbutyl)propanamide

N,2-dimethyl-N-(3-methylbutyl)propanamide (PubChem CID 60738277) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is N,2-dimethyl-N-(3-methylbutyl)propanamide.

Molecular Properties

Compound NameN,2-dimethyl-N-(3-methylbutyl)propanamide
PubChem CID60738277
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC NameN,2-dimethyl-N-(3-methylbutyl)propanamide
SMILESCC(C)CCN(C)C(=O)C(C)C
InChIInChI=1S/C10H21NO/c1-8(2)6-7-11(5)10(12)9(3)4/h8-9H,6-7H2,1-5H3
InChIKeyZZNHIYKQNFDDGB-UHFFFAOYSA-N
XLogP2.15
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
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,2-dimethyl-N-(3-methylbutyl)propanamide?
The IUPAC name of N,2-dimethyl-N-(3-methylbutyl)propanamide (CID 60738277) is N,2-dimethyl-N-(3-methylbutyl)propanamide.
What is the SMILES notation for N,2-dimethyl-N-(3-methylbutyl)propanamide?
The canonical SMILES for N,2-dimethyl-N-(3-methylbutyl)propanamide is CC(C)CCN(C)C(=O)C(C)C.
What is the InChIKey of N,2-dimethyl-N-(3-methylbutyl)propanamide?
The InChIKey is ZZNHIYKQNFDDGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-8(2)6-7-11(5)10(12)9(3)4/h8-9H,6-7H2,1-5H3.
What are the key properties of N,2-dimethyl-N-(3-methylbutyl)propanamide?
N,2-dimethyl-N-(3-methylbutyl)propanamide has a molecular weight of 171.28 g/mol, XLogP of 2.15, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-(3-methylbutyl)propanamide is sourced from PubChem (CID 60738277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).