3,4-dimethyl-N-propan-2-ylpentanamide

C10H21NO — CID 153056975

IUPAC3,4-dimethyl-N-propan-2-ylpentanamide
SMILESCC(C)NC(=O)CC(C)C(C)C
InChIInChI=1S/C10H21NO/c1-7(2)9(5)6-10(12)11-8(3)4/h7-9H,6H2,1-5H3,(H,11,12)
InChIKeyVIRLDXOBIXNTCD-UHFFFAOYSA-N
MW171.28 g/mol
LogP2.19
Rot. Bonds4

About 3,4-dimethyl-N-propan-2-ylpentanamide

3,4-dimethyl-N-propan-2-ylpentanamide (PubChem CID 153056975) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 3,4-dimethyl-N-propan-2-ylpentanamide.

Molecular Properties

Compound Name3,4-dimethyl-N-propan-2-ylpentanamide
PubChem CID153056975
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name3,4-dimethyl-N-propan-2-ylpentanamide
SMILESCC(C)NC(=O)CC(C)C(C)C
InChIInChI=1S/C10H21NO/c1-7(2)9(5)6-10(12)11-8(3)4/h7-9H,6H2,1-5H3,(H,11,12)
InChIKeyVIRLDXOBIXNTCD-UHFFFAOYSA-N
XLogP2.19
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3,3-difluoro-N-propan-2-ylpropanamide
CID 177328037
(2S)-2-(3,4-dimethylpentanoylamino)-4-methylpentanoic acid
CID 119361522
(2S,3S)-2-(3,4-dimethylpentanoylamino)-3-methylpentanoic acid
CID 119193969
3-(3-methylbutan-2-ylamino)-N-propan-2-ylbutanamide
CID 115724429
N-propan-2-ylpropanamide;dihydrochloride
CID 172679019
3,4-dimethyl-N-propylpentanamide
CID 89425193
3-cyano-N-propan-2-ylbutanamide
CID 82111212
methyl 3,4-dimethylpentanoate
CID 554058
N-[3-(aminomethyl)pentan-3-yl]-3,4-dimethylpentanamide
CID 119572055
N'-propan-2-yl-2-(propan-2-ylamino)butanediamide
CID 66431400
N,N'-di(propan-2-yl)decanediamide
CID 58997511
sodium 2-oxo-2-(propan-2-ylamino)ethanolate
CID 122705182

Frequently Asked Questions

What is the IUPAC name of 3,4-dimethyl-N-propan-2-ylpentanamide?
The IUPAC name of 3,4-dimethyl-N-propan-2-ylpentanamide (CID 153056975) is 3,4-dimethyl-N-propan-2-ylpentanamide.
What is the SMILES notation for 3,4-dimethyl-N-propan-2-ylpentanamide?
The canonical SMILES for 3,4-dimethyl-N-propan-2-ylpentanamide is CC(C)NC(=O)CC(C)C(C)C.
What is the InChIKey of 3,4-dimethyl-N-propan-2-ylpentanamide?
The InChIKey is VIRLDXOBIXNTCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-7(2)9(5)6-10(12)11-8(3)4/h7-9H,6H2,1-5H3,(H,11,12).
What are the key properties of 3,4-dimethyl-N-propan-2-ylpentanamide?
3,4-dimethyl-N-propan-2-ylpentanamide has a molecular weight of 171.28 g/mol, XLogP of 2.19, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethyl-N-propan-2-ylpentanamide is sourced from PubChem (CID 153056975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).