6-cyclohexyldecyl carbamate

C17H33NO2 — CID 70556984

IUPAC6-cyclohexyldecyl carbamate
SMILESCCCCC(CCCCCOC(N)=O)C1CCCCC1
InChIInChI=1S/C17H33NO2/c1-2-3-10-15(16-11-6-4-7-12-16)13-8-5-9-14-20-17(18)19/h15-16H,2-14H2,1H3,(H2,18,19)
InChIKeyVNTODLWHEZQBNB-UHFFFAOYSA-N
MW283.46 g/mol
LogP5.03
Rot. Bonds10

About 6-cyclohexyldecyl carbamate

6-cyclohexyldecyl carbamate (PubChem CID 70556984) has the molecular formula C17H33NO2 and a molecular weight of 283.46 g/mol. Its IUPAC name is 6-cyclohexyldecyl carbamate.

Molecular Properties

Compound Name6-cyclohexyldecyl carbamate
PubChem CID70556984
Molecular FormulaC17H33NO2
Molecular Weight283.46 g/mol
Exact Mass283.25
IUPAC Name6-cyclohexyldecyl carbamate
SMILESCCCCC(CCCCCOC(N)=O)C1CCCCC1
InChIInChI=1S/C17H33NO2/c1-2-3-10-15(16-11-6-4-7-12-16)13-8-5-9-14-20-17(18)19/h15-16H,2-14H2,1H3,(H2,18,19)
InChIKeyVNTODLWHEZQBNB-UHFFFAOYSA-N
XLogP5.03
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500283.46
LogP ≤ 55.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

undecan-5-ylcyclohexane
CID 524419
hexadecan-8-ylcyclohexane
CID 91510029
N'-(4-cyclohexylhexadecyl)oxamide
CID 21260052
octyl 2-amino-2-cyclohexylacetate
CID 63539863
2-O-(8-methylnonyl) 1-O-octyl cyclohexane-1,2-dicarboxylate
CID 66983566
2-O-(10-methylundecyl) 1-O-undecyl cyclohexane-1,2-dicarboxylate
CID 66984082
2-O-(5-methylhexyl) 1-O-nonyl cyclohexane-1,2-dicarboxylate
CID 66984027
2-O-(9-methyldecyl) 1-O-nonyl cyclohexane-1,2-dicarboxylate
CID 66984129
octacosyl carbamate
CID 160925840
CID 22214505
CID 22214505
2-O-dodecyl 1-O-heptyl cyclohexane-1,2-dicarboxylate
CID 66983243
2-O-(5-methylhexyl) 1-O-pentyl cyclohexane-1,2-dicarboxylate
CID 66983110

Frequently Asked Questions

What is the IUPAC name of 6-cyclohexyldecyl carbamate?
The IUPAC name of 6-cyclohexyldecyl carbamate (CID 70556984) is 6-cyclohexyldecyl carbamate.
What is the SMILES notation for 6-cyclohexyldecyl carbamate?
The canonical SMILES for 6-cyclohexyldecyl carbamate is CCCCC(CCCCCOC(N)=O)C1CCCCC1.
What is the InChIKey of 6-cyclohexyldecyl carbamate?
The InChIKey is VNTODLWHEZQBNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33NO2/c1-2-3-10-15(16-11-6-4-7-12-16)13-8-5-9-14-20-17(18)19/h15-16H,2-14H2,1H3,(H2,18,19).
What are the key properties of 6-cyclohexyldecyl carbamate?
6-cyclohexyldecyl carbamate has a molecular weight of 283.46 g/mol, XLogP of 5.03, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclohexyldecyl carbamate is sourced from PubChem (CID 70556984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).