N-tert-butyl-4-methyldecanamide

C15H31NO — CID 134368899

IUPACN-tert-butyl-4-methyldecanamide
SMILESCCCCCCC(C)CCC(=O)NC(C)(C)C
InChIInChI=1S/C15H31NO/c1-6-7-8-9-10-13(2)11-12-14(17)16-15(3,4)5/h13H,6-12H2,1-5H3,(H,16,17)
InChIKeyGDZVCPDSYPWQBB-UHFFFAOYSA-N
MW241.42 g/mol
LogP4.29
Rot. Bonds8

About N-tert-butyl-4-methyldecanamide

N-tert-butyl-4-methyldecanamide (PubChem CID 134368899) has the molecular formula C15H31NO and a molecular weight of 241.42 g/mol. Its IUPAC name is N-tert-butyl-4-methyldecanamide.

Molecular Properties

Compound NameN-tert-butyl-4-methyldecanamide
PubChem CID134368899
Molecular FormulaC15H31NO
Molecular Weight241.42 g/mol
Exact Mass241.24
IUPAC NameN-tert-butyl-4-methyldecanamide
SMILESCCCCCCC(C)CCC(=O)NC(C)(C)C
InChIInChI=1S/C15H31NO/c1-6-7-8-9-10-13(2)11-12-14(17)16-15(3,4)5/h13H,6-12H2,1-5H3,(H,16,17)
InChIKeyGDZVCPDSYPWQBB-UHFFFAOYSA-N
XLogP4.29
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.42
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

4-methyltetradecanoic acid
CID 23454322
N-tert-butyl-7,11-dipropyltetradecanamide
CID 144715726
4,8,12-trimethylnonadecanoic acid
CID 141295751
azane;methyl 4-methylhexadecanoate
CID 174610409
N-tert-butyl-2-(undecan-6-ylamino)acetamide
CID 115355945
8-methylhexadecanoic acid
CID 5312298
11-methylnonadecanoic acid
CID 52921772
7-methyloctadecanoic acid;8-methyloctadecanoic acid
CID 157148422
12-methylicosanoic acid
CID 15736271
9-methylpentadecanoic acid
CID 22251894
2-hexadecyl-8-methylicosanoic acid
CID 87355804
(6S)-6-methyltetradecanoic acid
CID 95858653

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-4-methyldecanamide?
The IUPAC name of N-tert-butyl-4-methyldecanamide (CID 134368899) is N-tert-butyl-4-methyldecanamide.
What is the SMILES notation for N-tert-butyl-4-methyldecanamide?
The canonical SMILES for N-tert-butyl-4-methyldecanamide is CCCCCCC(C)CCC(=O)NC(C)(C)C.
What is the InChIKey of N-tert-butyl-4-methyldecanamide?
The InChIKey is GDZVCPDSYPWQBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO/c1-6-7-8-9-10-13(2)11-12-14(17)16-15(3,4)5/h13H,6-12H2,1-5H3,(H,16,17).
What are the key properties of N-tert-butyl-4-methyldecanamide?
N-tert-butyl-4-methyldecanamide has a molecular weight of 241.42 g/mol, XLogP of 4.29, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-4-methyldecanamide is sourced from PubChem (CID 134368899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).