(3-aminocyclobutyl) N-(4-methylphenyl)carbamate

C12H16N2O2 — CID 79346677

IUPAC(3-aminocyclobutyl) N-(4-methylphenyl)carbamate
SMILESCc1ccc(NC(=O)OC2CC(N)C2)cc1
InChIInChI=1S/C12H16N2O2/c1-8-2-4-10(5-3-8)14-12(15)16-11-6-9(13)7-11/h2-5,9,11H,6-7,13H2,1H3,(H,14,15)
InChIKeyRITYKQSVYLDMAX-UHFFFAOYSA-N
MW220.27 g/mol
LogP2.03
Rot. Bonds2

About (3-aminocyclobutyl) N-(4-methylphenyl)carbamate

(3-aminocyclobutyl) N-(4-methylphenyl)carbamate (PubChem CID 79346677) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is (3-aminocyclobutyl) N-(4-methylphenyl)carbamate.

Molecular Properties

Compound Name(3-aminocyclobutyl) N-(4-methylphenyl)carbamate
PubChem CID79346677
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC Name(3-aminocyclobutyl) N-(4-methylphenyl)carbamate
SMILESCc1ccc(NC(=O)OC2CC(N)C2)cc1
InChIInChI=1S/C12H16N2O2/c1-8-2-4-10(5-3-8)14-12(15)16-11-6-9(13)7-11/h2-5,9,11H,6-7,13H2,1H3,(H,14,15)
InChIKeyRITYKQSVYLDMAX-UHFFFAOYSA-N
XLogP2.03
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (3-aminocyclobutyl) N-(4-methylphenyl)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

1-(3-aminocyclobutyl)-3-(4-methylphenyl)urea
CID 43596708
amino N-(4-methylphenyl)carbamate
CID 22737872
2-(3-aminocyclopentyl)oxy-N-(4-methylphenyl)acetamide
CID 79458232
[(3S,3aR,6S,6aS)-6-[(4-methylphenyl)carbamoyloxy]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl] N-(4-methylphenyl)carbamate
CID 11923061
(3,5-dimethylcyclohexyl) N-[4-(aminomethyl)phenyl]carbamate
CID 64730203
[3-(methylaminomethyl)cyclobutyl] N-(4-fluorophenyl)carbamate
CID 79345354
(4-aminocyclohexyl) N-(3-methylphenyl)carbamate
CID 79337441
ethane;ethyl N-(4-methylphenyl)carbamate
CID 143199598
cyclobutyl N-(4-aminophenyl)carbamate
CID 62139706
3-amino-N-(4-methylphenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119670946
butane;methyl N-(4-methylphenyl)carbamate
CID 155739087
(1-aminocycloheptyl)methyl N-(4-methylphenyl)carbamate
CID 79338062

Frequently Asked Questions

What is the IUPAC name of (3-aminocyclobutyl) N-(4-methylphenyl)carbamate?
The IUPAC name of (3-aminocyclobutyl) N-(4-methylphenyl)carbamate (CID 79346677) is (3-aminocyclobutyl) N-(4-methylphenyl)carbamate.
What is the SMILES notation for (3-aminocyclobutyl) N-(4-methylphenyl)carbamate?
The canonical SMILES for (3-aminocyclobutyl) N-(4-methylphenyl)carbamate is Cc1ccc(NC(=O)OC2CC(N)C2)cc1.
What is the InChIKey of (3-aminocyclobutyl) N-(4-methylphenyl)carbamate?
The InChIKey is RITYKQSVYLDMAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2/c1-8-2-4-10(5-3-8)14-12(15)16-11-6-9(13)7-11/h2-5,9,11H,6-7,13H2,1H3,(H,14,15).
What are the key properties of (3-aminocyclobutyl) N-(4-methylphenyl)carbamate?
(3-aminocyclobutyl) N-(4-methylphenyl)carbamate has a molecular weight of 220.27 g/mol, XLogP of 2.03, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-aminocyclobutyl) N-(4-methylphenyl)carbamate is sourced from PubChem (CID 79346677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).