(5-methyl-2-propan-2-ylcyclohexyl) N-(2-methylpropyl)carbamate

C15H29NO2 — CID 10244100

IUPAC(5-methyl-2-propan-2-ylcyclohexyl) N-(2-methylpropyl)carbamate
SMILESCC(C)CNC(=O)OC1CC(C)CCC1C(C)C
InChIInChI=1S/C15H29NO2/c1-10(2)9-16-15(17)18-14-8-12(5)6-7-13(14)11(3)4/h10-14H,6-9H2,1-5H3,(H,16,17)
InChIKeyOGWAITVDDYTMRF-UHFFFAOYSA-N
MW255.40 g/mol
LogP3.83
Rot. Bonds4

About (5-methyl-2-propan-2-ylcyclohexyl) N-(2-methylpropyl)carbamate

(5-methyl-2-propan-2-ylcyclohexyl) N-(2-methylpropyl)carbamate (PubChem CID 10244100) has the molecular formula C15H29NO2 and a molecular weight of 255.40 g/mol. Its IUPAC name is (5-methyl-2-propan-2-ylcyclohexyl) N-(2-methylpropyl)carbamate.

Molecular Properties

Compound Name(5-methyl-2-propan-2-ylcyclohexyl) N-(2-methylpropyl)carbamate
PubChem CID10244100
Molecular FormulaC15H29NO2
Molecular Weight255.40 g/mol
Exact Mass255.22
IUPAC Name(5-methyl-2-propan-2-ylcyclohexyl) N-(2-methylpropyl)carbamate
SMILESCC(C)CNC(=O)OC1CC(C)CCC1C(C)C
InChIInChI=1S/C15H29NO2/c1-10(2)9-16-15(17)18-14-8-12(5)6-7-13(14)11(3)4/h10-14H,6-9H2,1-5H3,(H,16,17)
InChIKeyOGWAITVDDYTMRF-UHFFFAOYSA-N
XLogP3.83
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.40
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5-methyl-2-propan-2-ylcyclohexyl) N-(2-methylpropyl)carbamate?
The IUPAC name of (5-methyl-2-propan-2-ylcyclohexyl) N-(2-methylpropyl)carbamate (CID 10244100) is (5-methyl-2-propan-2-ylcyclohexyl) N-(2-methylpropyl)carbamate.
What is the SMILES notation for (5-methyl-2-propan-2-ylcyclohexyl) N-(2-methylpropyl)carbamate?
The canonical SMILES for (5-methyl-2-propan-2-ylcyclohexyl) N-(2-methylpropyl)carbamate is CC(C)CNC(=O)OC1CC(C)CCC1C(C)C.
What is the InChIKey of (5-methyl-2-propan-2-ylcyclohexyl) N-(2-methylpropyl)carbamate?
The InChIKey is OGWAITVDDYTMRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO2/c1-10(2)9-16-15(17)18-14-8-12(5)6-7-13(14)11(3)4/h10-14H,6-9H2,1-5H3,(H,16,17).
What are the key properties of (5-methyl-2-propan-2-ylcyclohexyl) N-(2-methylpropyl)carbamate?
(5-methyl-2-propan-2-ylcyclohexyl) N-(2-methylpropyl)carbamate has a molecular weight of 255.40 g/mol, XLogP of 3.83, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methyl-2-propan-2-ylcyclohexyl) N-(2-methylpropyl)carbamate is sourced from PubChem (CID 10244100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).