[3-(dimethylamino)phenyl] carbamate

C9H12N2O2 — CID 23622089

IUPAC[3-(dimethylamino)phenyl] carbamate
SMILESCN(C)c1cccc(OC(N)=O)c1
InChIInChI=1S/C9H12N2O2/c1-11(2)7-4-3-5-8(6-7)13-9(10)12/h3-6H,1-2H3,(H2,10,12)
InChIKeyRDTPOOGPKATERY-UHFFFAOYSA-N
MW180.21 g/mol
LogP1.21
Rot. Bonds2

About [3-(dimethylamino)phenyl] carbamate

[3-(dimethylamino)phenyl] carbamate (PubChem CID 23622089) has the molecular formula C9H12N2O2 and a molecular weight of 180.21 g/mol. Its IUPAC name is [3-(dimethylamino)phenyl] carbamate.

Molecular Properties

Compound Name[3-(dimethylamino)phenyl] carbamate
PubChem CID23622089
Molecular FormulaC9H12N2O2
Molecular Weight180.21 g/mol
Exact Mass180.09
IUPAC Name[3-(dimethylamino)phenyl] carbamate
SMILESCN(C)c1cccc(OC(N)=O)c1
InChIInChI=1S/C9H12N2O2/c1-11(2)7-4-3-5-8(6-7)13-9(10)12/h3-6H,1-2H3,(H2,10,12)
InChIKeyRDTPOOGPKATERY-UHFFFAOYSA-N
XLogP1.21
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.21
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [3-(dimethylamino)phenyl] carbamate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[3-(dimethylamino)phenyl] 2-methylprop-2-enoate
CID 18954612
2-[3-(dimethylamino)phenoxy]propanoic acid
CID 22683634
[3-(dimethylamino)phenyl] 4-(hydroxymethyl)benzoate
CID 118525315
[3-(dimethylamino)phenyl] N-benzyl-N-methylcarbamate
CID 13371954
methyl 3-carbamoyloxybenzoate
CID 795113
3-amino-4-[3-(dimethylamino)phenoxy]butanoic acid
CID 112511325
4-[2-[3-(dimethylamino)phenoxy]ethoxy]benzoic acid
CID 20985248
2-[3-(dimethylamino)phenoxy]-1-phenylethanone
CID 60773053
[3-(difluoromethyl)phenyl] carbamate
CID 69370521
[3-(trifluoromethyl)phenyl] carbamate
CID 56614861
1-[3-(dimethylamino)phenoxy]cyclopentane-1-carboxylic acid
CID 82131344
(E)-4-[3-(dimethylamino)phenoxy]but-2-enoic acid
CID 62343701

Frequently Asked Questions

What is the IUPAC name of [3-(dimethylamino)phenyl] carbamate?
The IUPAC name of [3-(dimethylamino)phenyl] carbamate (CID 23622089) is [3-(dimethylamino)phenyl] carbamate.
What is the SMILES notation for [3-(dimethylamino)phenyl] carbamate?
The canonical SMILES for [3-(dimethylamino)phenyl] carbamate is CN(C)c1cccc(OC(N)=O)c1.
What is the InChIKey of [3-(dimethylamino)phenyl] carbamate?
The InChIKey is RDTPOOGPKATERY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O2/c1-11(2)7-4-3-5-8(6-7)13-9(10)12/h3-6H,1-2H3,(H2,10,12).
What are the key properties of [3-(dimethylamino)phenyl] carbamate?
[3-(dimethylamino)phenyl] carbamate has a molecular weight of 180.21 g/mol, XLogP of 1.21, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(dimethylamino)phenyl] carbamate is sourced from PubChem (CID 23622089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).