benzo[h]quinolin-10-yl N-methylcarbamate

C15H12N2O2 — CID 139035586

IUPACbenzo[h]quinolin-10-yl N-methylcarbamate
SMILESCNC(=O)Oc1cccc2ccc3cccnc3c12
InChIInChI=1S/C15H12N2O2/c1-16-15(18)19-12-6-2-4-10-7-8-11-5-3-9-17-14(11)13(10)12/h2-9H,1H3,(H,16,18)
InChIKeySPSFOKBUNCZELD-UHFFFAOYSA-N
MW252.27 g/mol
LogP3.11
Rot. Bonds1

About benzo[h]quinolin-10-yl N-methylcarbamate

benzo[h]quinolin-10-yl N-methylcarbamate (PubChem CID 139035586) has the molecular formula C15H12N2O2 and a molecular weight of 252.27 g/mol. Its IUPAC name is benzo[h]quinolin-10-yl N-methylcarbamate.

Molecular Properties

Compound Namebenzo[h]quinolin-10-yl N-methylcarbamate
PubChem CID139035586
Molecular FormulaC15H12N2O2
Molecular Weight252.27 g/mol
Exact Mass252.09
IUPAC Namebenzo[h]quinolin-10-yl N-methylcarbamate
SMILESCNC(=O)Oc1cccc2ccc3cccnc3c12
InChIInChI=1S/C15H12N2O2/c1-16-15(18)19-12-6-2-4-10-7-8-11-5-3-9-17-14(11)13(10)12/h2-9H,1H3,(H,16,18)
InChIKeySPSFOKBUNCZELD-UHFFFAOYSA-N
XLogP3.11
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.27
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze benzo[h]quinolin-10-yl N-methylcarbamate 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

benzo[h]quinolin-10-yl 3-methylbenzoate
CID 132509817
10-[2-(benzo[h]quinolin-10-yloxymethyl)prop-2-enoxy]benzo[h]quinoline
CID 15268948
naphthalen-1-yl N-methylcarbamate
CID 23447097
(2,3-dimethylquinolin-8-yl) N-methylcarbamate
CID 69053510
quinolin-8-yl N-(2,4-dimethylphenyl)carbamate
CID 3307290
3-(quinolin-8-yloxycarbonylamino)propanoic acid
CID 116819716
magnesium;hydride;naphthalen-1-yl N-methylcarbamate
CID 173327127
calcium;hydride;naphthalen-1-yl N-methylcarbamate
CID 173073118
quinolin-8-yl N-(4-ethoxyphenyl)carbamate
CID 3434150
quinolin-8-yl N-(3,4-dichlorophenyl)carbamate
CID 3623243
diquinolin-8-yl benzene-1,2-dicarboxylate
CID 154085915
quinolin-8-yl N-(4-chloro-2-methylphenyl)carbamate
CID 4114016

Frequently Asked Questions

What is the IUPAC name of benzo[h]quinolin-10-yl N-methylcarbamate?
The IUPAC name of benzo[h]quinolin-10-yl N-methylcarbamate (CID 139035586) is benzo[h]quinolin-10-yl N-methylcarbamate.
What is the SMILES notation for benzo[h]quinolin-10-yl N-methylcarbamate?
The canonical SMILES for benzo[h]quinolin-10-yl N-methylcarbamate is CNC(=O)Oc1cccc2ccc3cccnc3c12.
What is the InChIKey of benzo[h]quinolin-10-yl N-methylcarbamate?
The InChIKey is SPSFOKBUNCZELD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O2/c1-16-15(18)19-12-6-2-4-10-7-8-11-5-3-9-17-14(11)13(10)12/h2-9H,1H3,(H,16,18).
What are the key properties of benzo[h]quinolin-10-yl N-methylcarbamate?
benzo[h]quinolin-10-yl N-methylcarbamate has a molecular weight of 252.27 g/mol, XLogP of 3.11, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for benzo[h]quinolin-10-yl N-methylcarbamate is sourced from PubChem (CID 139035586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).