(2-amino-6-methylphenyl) N,N-dimethylcarbamate

C10H14N2O2 — CID 131207405

IUPAC(2-amino-6-methylphenyl) N,N-dimethylcarbamate
SMILESCc1cccc(N)c1OC(=O)N(C)C
InChIInChI=1S/C10H14N2O2/c1-7-5-4-6-8(11)9(7)14-10(13)12(2)3/h4-6H,11H2,1-3H3
InChIKeyHTEDAHUSMRIQDG-UHFFFAOYSA-N
MW194.23 g/mol
LogP1.64
Rot. Bonds1

About (2-amino-6-methylphenyl) N,N-dimethylcarbamate

(2-amino-6-methylphenyl) N,N-dimethylcarbamate (PubChem CID 131207405) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is (2-amino-6-methylphenyl) N,N-dimethylcarbamate.

Molecular Properties

Compound Name(2-amino-6-methylphenyl) N,N-dimethylcarbamate
PubChem CID131207405
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name(2-amino-6-methylphenyl) N,N-dimethylcarbamate
SMILESCc1cccc(N)c1OC(=O)N(C)C
InChIInChI=1S/C10H14N2O2/c1-7-5-4-6-8(11)9(7)14-10(13)12(2)3/h4-6H,11H2,1-3H3
InChIKeyHTEDAHUSMRIQDG-UHFFFAOYSA-N
XLogP1.64
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(2-amino-6-methylphenyl) N-butylcarbamate
CID 91044635
3-[(2,6-dimethylphenoxy)carbonyl-methylamino]propanoic acid
CID 116819740
[4-(dimethylcarbamoyloxy)-2,3-dimethoxynaphthalen-1-yl] N,N-dimethylcarbamate
CID 14302870
(4-aminophenyl) N,N-dimethylcarbamate
CID 21427559
3-(2,6-dimethylphenoxy)-N-methylpropanehydrazide
CID 116820445
[2-(dimethylcarbamoyloxy)-3-[(trimethylazaniumyl)methyl]phenyl]methyl-trimethylazanium
CID 135121841
2-(2-methoxyethoxy)-3-methylaniline
CID 115550862
[2,6-bis(prop-2-enyl)phenyl] N,N-dimethylcarbamate
CID 518063
2-(3-amino-2-methoxyphenyl)-N,N-dimethylacetamide;hydrochloride
CID 166541260
2,3-dimethylaniline;N,N-dimethylmethanamine
CID 69304768
3-methyl-2-(4-methylpentan-2-yloxy)aniline
CID 115550876
(2,6-dimethylphenyl) 2-bromopropanoate
CID 167289802

Frequently Asked Questions

What is the IUPAC name of (2-amino-6-methylphenyl) N,N-dimethylcarbamate?
The IUPAC name of (2-amino-6-methylphenyl) N,N-dimethylcarbamate (CID 131207405) is (2-amino-6-methylphenyl) N,N-dimethylcarbamate.
What is the SMILES notation for (2-amino-6-methylphenyl) N,N-dimethylcarbamate?
The canonical SMILES for (2-amino-6-methylphenyl) N,N-dimethylcarbamate is Cc1cccc(N)c1OC(=O)N(C)C.
What is the InChIKey of (2-amino-6-methylphenyl) N,N-dimethylcarbamate?
The InChIKey is HTEDAHUSMRIQDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-7-5-4-6-8(11)9(7)14-10(13)12(2)3/h4-6H,11H2,1-3H3.
What are the key properties of (2-amino-6-methylphenyl) N,N-dimethylcarbamate?
(2-amino-6-methylphenyl) N,N-dimethylcarbamate has a molecular weight of 194.23 g/mol, XLogP of 1.64, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-6-methylphenyl) N,N-dimethylcarbamate is sourced from PubChem (CID 131207405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).