N-methyl-N-(2-methylphenyl)carbamate

C9H10NO2- — CID 21115000

IUPACN-methyl-N-(2-methylphenyl)carbamate
SMILESCc1ccccc1N(C)C(=O)[O-]
InChIInChI=1S/C9H11NO2/c1-7-5-3-4-6-8(7)10(2)9(11)12/h3-6H,1-2H3,(H,11,12)/p-1
InChIKeyWBRPERGSJWGDBL-UHFFFAOYSA-M
MW164.18 g/mol
LogP0.77
Rot. Bonds1

About N-methyl-N-(2-methylphenyl)carbamate

N-methyl-N-(2-methylphenyl)carbamate (PubChem CID 21115000) has the molecular formula C9H10NO2- and a molecular weight of 164.18 g/mol. Its IUPAC name is N-methyl-N-(2-methylphenyl)carbamate.

Molecular Properties

Compound NameN-methyl-N-(2-methylphenyl)carbamate
PubChem CID21115000
Molecular FormulaC9H10NO2-
Molecular Weight164.18 g/mol
Exact Mass164.07
IUPAC NameN-methyl-N-(2-methylphenyl)carbamate
SMILESCc1ccccc1N(C)C(=O)[O-]
InChIInChI=1S/C9H11NO2/c1-7-5-3-4-6-8(7)10(2)9(11)12/h3-6H,1-2H3,(H,11,12)/p-1
InChIKeyWBRPERGSJWGDBL-UHFFFAOYSA-M
XLogP0.77
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.18
LogP ≤ 50.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,2-dimethyl-N-(2-methylphenyl)benzamide
CID 71395326
2-amino-N-methyl-N-(2-methylphenyl)acetamide
CID 28794373
2,2,2-trifluoro-N-methyl-N-(2-methylphenyl)acetamide
CID 15256877
2-(dimethylamino)-N-methyl-N-(2-methylphenyl)acetamide
CID 21343400
3-tert-butyl-1-methyl-1-(2-methylphenyl)urea
CID 116655388
2-hydroxy-N-methyl-N-(2-methylphenyl)benzamide
CID 20668349
N-methyl-N-(2-methylphenyl)cyclopropanecarboxamide
CID 64593225
3-amino-N-methyl-N-(2-methylphenyl)propanamide
CID 28794972
hexane;methyl-(2-methylphenyl)carbamic acid
CID 174980979
2-[carboxymethyl-[methyl-(2-methylphenyl)carbamoyl]amino]acetic acid
CID 63644818
3-(N,2-dimethylanilino)-2,2-dimethyl-3-oxopropanoic acid
CID 82821859
(2-methylphenyl)-oxidocarbamic acid
CID 131721115

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-methylphenyl)carbamate?
The IUPAC name of N-methyl-N-(2-methylphenyl)carbamate (CID 21115000) is N-methyl-N-(2-methylphenyl)carbamate.
What is the SMILES notation for N-methyl-N-(2-methylphenyl)carbamate?
The canonical SMILES for N-methyl-N-(2-methylphenyl)carbamate is Cc1ccccc1N(C)C(=O)[O-].
What is the InChIKey of N-methyl-N-(2-methylphenyl)carbamate?
The InChIKey is WBRPERGSJWGDBL-UHFFFAOYSA-M. The full InChI is InChI=1S/C9H11NO2/c1-7-5-3-4-6-8(7)10(2)9(11)12/h3-6H,1-2H3,(H,11,12)/p-1.
What are the key properties of N-methyl-N-(2-methylphenyl)carbamate?
N-methyl-N-(2-methylphenyl)carbamate has a molecular weight of 164.18 g/mol, XLogP of 0.77, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-methylphenyl)carbamate is sourced from PubChem (CID 21115000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).