(2-methylcyclohexyl) N-(2-methoxyphenyl)carbamate

C15H21NO3 — CID 3641247

IUPAC(2-methylcyclohexyl) N-(2-methoxyphenyl)carbamate
SMILESCOc1ccccc1NC(=O)OC1CCCCC1C
InChIInChI=1S/C15H21NO3/c1-11-7-3-5-9-13(11)19-15(17)16-12-8-4-6-10-14(12)18-2/h4,6,8,10-11,13H,3,5,7,9H2,1-2H3,(H,16,17)
InChIKeyNAPJGNIEIAQPDH-UHFFFAOYSA-N
MW263.34 g/mol
LogP3.82
Rot. Bonds3

About (2-methylcyclohexyl) N-(2-methoxyphenyl)carbamate

(2-methylcyclohexyl) N-(2-methoxyphenyl)carbamate (PubChem CID 3641247) has the molecular formula C15H21NO3 and a molecular weight of 263.34 g/mol. Its IUPAC name is (2-methylcyclohexyl) N-(2-methoxyphenyl)carbamate.

Molecular Properties

Compound Name(2-methylcyclohexyl) N-(2-methoxyphenyl)carbamate
PubChem CID3641247
Molecular FormulaC15H21NO3
Molecular Weight263.34 g/mol
Exact Mass263.15
IUPAC Name(2-methylcyclohexyl) N-(2-methoxyphenyl)carbamate
SMILESCOc1ccccc1NC(=O)OC1CCCCC1C
InChIInChI=1S/C15H21NO3/c1-11-7-3-5-9-13(11)19-15(17)16-12-8-4-6-10-14(12)18-2/h4,6,8,10-11,13H,3,5,7,9H2,1-2H3,(H,16,17)
InChIKeyNAPJGNIEIAQPDH-UHFFFAOYSA-N
XLogP3.82
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methoxyphenyl)-3-[(1R,2R)-2-methylcyclohexyl]urea
CID 40636375
(3-aminocyclohexyl) N-(2-methoxyphenyl)carbamate
CID 79465855
piperidin-2-ylmethyl N-(2-methoxyphenyl)carbamate
CID 79337607
propan-2-yl N-(2-methoxyphenyl)carbamate
CID 5047637
2-cyclohexyl-N-(2-methoxyphenyl)acetamide
CID 880879
[(1S,2R)-2-methylcyclohexyl] N-[4-[[4-[[(1S,2R)-2-methylcyclohexyl]oxycarbonylamino]phenyl]methyl]phenyl]carbamate
CID 124919110
[(1R,5R)-3,3,5-trimethylcyclohexyl] N-(2-methoxyphenyl)carbamate
CID 142739719
2-hydroxy-N-(2-methoxyphenyl)cyclopentane-1-carboxamide
CID 110013580
trans-(1S,2S)-2-[(2-methoxyphenyl)carbamoyl]cyclohexane-1-carboxylate
CID 6940396
N-[(2-methoxyphenyl)carbamothioyl]cyclohexanecarboxamide
CID 804772
(2-methylcyclohexyl) 2-methoxybenzenecarboperoxoate
CID 173266386
N-(2-methoxyphenyl)-2-(3-methylpiperidin-2-yl)acetamide
CID 107147403

Frequently Asked Questions

What is the IUPAC name of (2-methylcyclohexyl) N-(2-methoxyphenyl)carbamate?
The IUPAC name of (2-methylcyclohexyl) N-(2-methoxyphenyl)carbamate (CID 3641247) is (2-methylcyclohexyl) N-(2-methoxyphenyl)carbamate.
What is the SMILES notation for (2-methylcyclohexyl) N-(2-methoxyphenyl)carbamate?
The canonical SMILES for (2-methylcyclohexyl) N-(2-methoxyphenyl)carbamate is COc1ccccc1NC(=O)OC1CCCCC1C.
What is the InChIKey of (2-methylcyclohexyl) N-(2-methoxyphenyl)carbamate?
The InChIKey is NAPJGNIEIAQPDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO3/c1-11-7-3-5-9-13(11)19-15(17)16-12-8-4-6-10-14(12)18-2/h4,6,8,10-11,13H,3,5,7,9H2,1-2H3,(H,16,17).
What are the key properties of (2-methylcyclohexyl) N-(2-methoxyphenyl)carbamate?
(2-methylcyclohexyl) N-(2-methoxyphenyl)carbamate has a molecular weight of 263.34 g/mol, XLogP of 3.82, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylcyclohexyl) N-(2-methoxyphenyl)carbamate is sourced from PubChem (CID 3641247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).