2-methylheptanamide;2-methylhexanamide

C15H32N2O2 — CID 160718848

IUPAC2-methylheptanamide;2-methylhexanamide
SMILESCCCCC(C)C(N)=O.CCCCCC(C)C(N)=O
InChIInChI=1S/C8H17NO.C7H15NO/c1-3-4-5-6-7(2)8(9)10;1-3-4-5-6(2)7(8)9/h7H,3-6H2,1-2H3,(H2,9,10);6H,3-5H2,1-2H3,(H2,8,9)
InChIKeyRSVHAKVSMCGYQT-UHFFFAOYSA-N
MW272.43 g/mol
LogP2.99
Rot. Bonds9

About 2-methylheptanamide;2-methylhexanamide

2-methylheptanamide;2-methylhexanamide (PubChem CID 160718848) has the molecular formula C15H32N2O2 and a molecular weight of 272.43 g/mol. Its IUPAC name is 2-methylheptanamide;2-methylhexanamide.

Molecular Properties

Compound Name2-methylheptanamide;2-methylhexanamide
PubChem CID160718848
Molecular FormulaC15H32N2O2
Molecular Weight272.43 g/mol
Exact Mass272.25
IUPAC Name2-methylheptanamide;2-methylhexanamide
SMILESCCCCC(C)C(N)=O.CCCCCC(C)C(N)=O
InChIInChI=1S/C8H17NO.C7H15NO/c1-3-4-5-6-7(2)8(9)10;1-3-4-5-6(2)7(8)9/h7H,3-6H2,1-2H3,(H2,9,10);6H,3-5H2,1-2H3,(H2,8,9)
InChIKeyRSVHAKVSMCGYQT-UHFFFAOYSA-N
XLogP2.99
TPSA86.18 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.43
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-methylheptanamide;2-methylhexanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-methylhexanamide
CID 2828737
sodium;hydride;2-methyloctanamide
CID 174470127
(E)-2-methyloctadec-9-enamide
CID 19371032
2-methyloctanamide;9-octylheptadecan-9-amine
CID 175322603
2-methylicosa-11,14-dienamide
CID 175746328
2-butyltetradecanamide
CID 57191211
2-butyldodecanamide
CID 88685822
3-(heptan-2-ylamino)-2-methylpropanamide
CID 61464618
(3R)-3-methyloctan-2-one
CID 158725350
2-methyloctanoyl 2-methyloctaneperoxoate
CID 71367675
3-methyloctadecan-2-one
CID 89177698
ethyl 2-methylhexanoate
CID 12714009

Frequently Asked Questions

What is the IUPAC name of 2-methylheptanamide;2-methylhexanamide?
The IUPAC name of 2-methylheptanamide;2-methylhexanamide (CID 160718848) is 2-methylheptanamide;2-methylhexanamide.
What is the SMILES notation for 2-methylheptanamide;2-methylhexanamide?
The canonical SMILES for 2-methylheptanamide;2-methylhexanamide is CCCCC(C)C(N)=O.CCCCCC(C)C(N)=O.
What is the InChIKey of 2-methylheptanamide;2-methylhexanamide?
The InChIKey is RSVHAKVSMCGYQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO.C7H15NO/c1-3-4-5-6-7(2)8(9)10;1-3-4-5-6(2)7(8)9/h7H,3-6H2,1-2H3,(H2,9,10);6H,3-5H2,1-2H3,(H2,8,9).
What are the key properties of 2-methylheptanamide;2-methylhexanamide?
2-methylheptanamide;2-methylhexanamide has a molecular weight of 272.43 g/mol, XLogP of 2.99, 9 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylheptanamide;2-methylhexanamide is sourced from PubChem (CID 160718848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).