N-(2-chloro-2-cyclopropylethyl)decanamide

C15H28ClNO — CID 113273435

IUPACN-(2-chloro-2-cyclopropylethyl)decanamide
SMILESCCCCCCCCCC(=O)NCC(Cl)C1CC1
InChIInChI=1S/C15H28ClNO/c1-2-3-4-5-6-7-8-9-15(18)17-12-14(16)13-10-11-13/h13-14H,2-12H2,1H3,(H,17,18)
InChIKeyPRCISQYJWWSQMQ-UHFFFAOYSA-N
MW273.85 g/mol
LogP4.26
Rot. Bonds11

About N-(2-chloro-2-cyclopropylethyl)decanamide

N-(2-chloro-2-cyclopropylethyl)decanamide (PubChem CID 113273435) has the molecular formula C15H28ClNO and a molecular weight of 273.85 g/mol. Its IUPAC name is N-(2-chloro-2-cyclopropylethyl)decanamide.

Molecular Properties

Compound NameN-(2-chloro-2-cyclopropylethyl)decanamide
PubChem CID113273435
Molecular FormulaC15H28ClNO
Molecular Weight273.85 g/mol
Exact Mass273.19
IUPAC NameN-(2-chloro-2-cyclopropylethyl)decanamide
SMILESCCCCCCCCCC(=O)NCC(Cl)C1CC1
InChIInChI=1S/C15H28ClNO/c1-2-3-4-5-6-7-8-9-15(18)17-12-14(16)13-10-11-13/h13-14H,2-12H2,1H3,(H,17,18)
InChIKeyPRCISQYJWWSQMQ-UHFFFAOYSA-N
XLogP4.26
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.85
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-(2-cyclopropyl-2-hydroxyethyl)nonanamide
CID 63294974
N-(2-bromo-2-cyclopropylethyl)dodecanamide
CID 114315926
N-(2-chloro-3-methylbutyl)heptanamide
CID 114754075
N-[3-(hexadecanoylamino)-2-methylpropyl]hexadecanamide
CID 130353709
methyl 2-chloro-3-(decanoylamino)propanoate
CID 103492807
N-(2-hydroxypropyl)nonadecanamide
CID 102118860
N-(2-chloro-4,4-dimethylpentyl)heptanamide
CID 107156793
N-(2-aminopropyl)octadecanamide
CID 86003506
N-(4-chloro-2-methylbutyl)nonanamide
CID 114306121
N-[(4-chlorocyclohexyl)methyl]octanamide
CID 106133761
N-[2-(heptadecanoylamino)ethyl]heptadecanamide
CID 22065407
N-ethylhexadecanamide
CID 18377756

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-2-cyclopropylethyl)decanamide?
The IUPAC name of N-(2-chloro-2-cyclopropylethyl)decanamide (CID 113273435) is N-(2-chloro-2-cyclopropylethyl)decanamide.
What is the SMILES notation for N-(2-chloro-2-cyclopropylethyl)decanamide?
The canonical SMILES for N-(2-chloro-2-cyclopropylethyl)decanamide is CCCCCCCCCC(=O)NCC(Cl)C1CC1.
What is the InChIKey of N-(2-chloro-2-cyclopropylethyl)decanamide?
The InChIKey is PRCISQYJWWSQMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28ClNO/c1-2-3-4-5-6-7-8-9-15(18)17-12-14(16)13-10-11-13/h13-14H,2-12H2,1H3,(H,17,18).
What are the key properties of N-(2-chloro-2-cyclopropylethyl)decanamide?
N-(2-chloro-2-cyclopropylethyl)decanamide has a molecular weight of 273.85 g/mol, XLogP of 4.26, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-2-cyclopropylethyl)decanamide is sourced from PubChem (CID 113273435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).