N-(2-hexyldecyl)formamide

C17H35NO — CID 54204817

IUPACN-(2-hexyldecyl)formamide
SMILESCCCCCCCCC(CCCCCC)CNC=O
InChIInChI=1S/C17H35NO/c1-3-5-7-9-10-12-14-17(15-18-16-19)13-11-8-6-4-2/h16-17H,3-15H2,1-2H3,(H,18,19)
InChIKeySCAHFGZEBJGIQS-UHFFFAOYSA-N
MW269.47 g/mol
LogP5.07
Rot. Bonds15

About N-(2-hexyldecyl)formamide

N-(2-hexyldecyl)formamide (PubChem CID 54204817) has the molecular formula C17H35NO and a molecular weight of 269.47 g/mol. Its IUPAC name is N-(2-hexyldecyl)formamide.

Molecular Properties

Compound NameN-(2-hexyldecyl)formamide
PubChem CID54204817
Molecular FormulaC17H35NO
Molecular Weight269.47 g/mol
Exact Mass269.27
IUPAC NameN-(2-hexyldecyl)formamide
SMILESCCCCCCCCC(CCCCCC)CNC=O
InChIInChI=1S/C17H35NO/c1-3-5-7-9-10-12-14-17(15-18-16-19)13-11-8-6-4-2/h16-17H,3-15H2,1-2H3,(H,18,19)
InChIKeySCAHFGZEBJGIQS-UHFFFAOYSA-N
XLogP5.07
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds15
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500269.47
LogP ≤ 55.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-(5-heptyltridecyl)formamide
CID 166649045
N-(2-methylnonyl)formamide
CID 146433499
N-(4-butyldecyl)formamide
CID 166649158
2-hexyl-N-(2-hexyldodecyl)dodecan-1-amine
CID 141299280
3-(2-tetradecyloctadecylamino)propanal
CID 54068246
5-ethylundecanal
CID 54527856
N-ethyl-2-propylnonan-1-amine
CID 63498677
4-oxo-N-(2-tetradecylhexadecyl)butanamide
CID 135292881
N-tetracosylformamide
CID 54077607
N-[2-(formamidomethyl)butyl]formamide
CID 59861734
N-pentacosylformamide
CID 88723962
3-nonyldodecanal
CID 142613821

Frequently Asked Questions

What is the IUPAC name of N-(2-hexyldecyl)formamide?
The IUPAC name of N-(2-hexyldecyl)formamide (CID 54204817) is N-(2-hexyldecyl)formamide.
What is the SMILES notation for N-(2-hexyldecyl)formamide?
The canonical SMILES for N-(2-hexyldecyl)formamide is CCCCCCCCC(CCCCCC)CNC=O.
What is the InChIKey of N-(2-hexyldecyl)formamide?
The InChIKey is SCAHFGZEBJGIQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H35NO/c1-3-5-7-9-10-12-14-17(15-18-16-19)13-11-8-6-4-2/h16-17H,3-15H2,1-2H3,(H,18,19).
What are the key properties of N-(2-hexyldecyl)formamide?
N-(2-hexyldecyl)formamide has a molecular weight of 269.47 g/mol, XLogP of 5.07, 15 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hexyldecyl)formamide is sourced from PubChem (CID 54204817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).