benzyl N-[3-[(6-ethoxy-3-pyridinyl)amino]cyclobutyl]carbamate

C19H23N3O3 — CID 103393572

IUPACbenzyl N-[3-[(6-ethoxy-3-pyridinyl)amino]cyclobutyl]carbamate
SMILESCCOc1ccc(NC2CC(NC(=O)OCc3ccccc3)C2)cn1
InChIInChI=1S/C19H23N3O3/c1-2-24-18-9-8-15(12-20-18)21-16-10-17(11-16)22-19(23)25-13-14-6-4-3-5-7-14/h3-9,12,16-17,21H,2,10-11,13H2,1H3,(H,22,23)
InChIKeyIXCXMFPRALKMGT-UHFFFAOYSA-N
MW341.41 g/mol
LogP3.35
Rot. Bonds7

About benzyl N-[3-[(6-ethoxy-3-pyridinyl)amino]cyclobutyl]carbamate

benzyl N-[3-[(6-ethoxy-3-pyridinyl)amino]cyclobutyl]carbamate (PubChem CID 103393572) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is benzyl N-[3-[(6-ethoxy-3-pyridinyl)amino]cyclobutyl]carbamate.

Molecular Properties

Compound Namebenzyl N-[3-[(6-ethoxy-3-pyridinyl)amino]cyclobutyl]carbamate
PubChem CID103393572
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC Namebenzyl N-[3-[(6-ethoxy-3-pyridinyl)amino]cyclobutyl]carbamate
SMILESCCOc1ccc(NC2CC(NC(=O)OCc3ccccc3)C2)cn1
InChIInChI=1S/C19H23N3O3/c1-2-24-18-9-8-15(12-20-18)21-16-10-17(11-16)22-19(23)25-13-14-6-4-3-5-7-14/h3-9,12,16-17,21H,2,10-11,13H2,1H3,(H,22,23)
InChIKeyIXCXMFPRALKMGT-UHFFFAOYSA-N
XLogP3.35
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze benzyl N-[3-[(6-ethoxy-3-pyridinyl)amino]cyclobutyl]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

benzyl N-[3-[(6-methyl-3-pyridinyl)amino]cyclobutyl]carbamate
CID 103393638
benzyl N-[3-(4-ethoxyanilino)cyclobutyl]carbamate
CID 103392743
benzyl N-[3,5-bis(phenylmethoxycarbonylamino)cyclohexyl]carbamate
CID 102080822
benzyl N-[3-(quinoxalin-6-ylamino)cyclobutyl]carbamate
CID 103393221
benzyl N-[3-(4-methylsulfonylanilino)cyclobutyl]carbamate
CID 103392797
benzyl N-[3-(3,5-dichloroanilino)cyclobutyl]carbamate
CID 103392779
benzyl N-[3-[4-(cyanomethoxy)anilino]cyclobutyl]carbamate
CID 103392875
benzyl N-[3-(2-methoxyanilino)cyclobutyl]carbamate
CID 103392742
benzyl N-[3-(1H-indazol-5-ylamino)cyclobutyl]carbamate
CID 103393058
benzyl N-[3-(3-bromo-4-methoxyanilino)cyclobutyl]carbamate
CID 103393510
benzyl N-[3-(3-carbamoylanilino)cyclobutyl]carbamate
CID 103392870
benzyl N-[3-(3-iodoanilino)cyclobutyl]carbamate
CID 103392947

Frequently Asked Questions

What is the IUPAC name of benzyl N-[3-[(6-ethoxy-3-pyridinyl)amino]cyclobutyl]carbamate?
The IUPAC name of benzyl N-[3-[(6-ethoxy-3-pyridinyl)amino]cyclobutyl]carbamate (CID 103393572) is benzyl N-[3-[(6-ethoxy-3-pyridinyl)amino]cyclobutyl]carbamate.
What is the SMILES notation for benzyl N-[3-[(6-ethoxy-3-pyridinyl)amino]cyclobutyl]carbamate?
The canonical SMILES for benzyl N-[3-[(6-ethoxy-3-pyridinyl)amino]cyclobutyl]carbamate is CCOc1ccc(NC2CC(NC(=O)OCc3ccccc3)C2)cn1.
What is the InChIKey of benzyl N-[3-[(6-ethoxy-3-pyridinyl)amino]cyclobutyl]carbamate?
The InChIKey is IXCXMFPRALKMGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-2-24-18-9-8-15(12-20-18)21-16-10-17(11-16)22-19(23)25-13-14-6-4-3-5-7-14/h3-9,12,16-17,21H,2,10-11,13H2,1H3,(H,22,23).
What are the key properties of benzyl N-[3-[(6-ethoxy-3-pyridinyl)amino]cyclobutyl]carbamate?
benzyl N-[3-[(6-ethoxy-3-pyridinyl)amino]cyclobutyl]carbamate has a molecular weight of 341.41 g/mol, XLogP of 3.35, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl N-[3-[(6-ethoxy-3-pyridinyl)amino]cyclobutyl]carbamate is sourced from PubChem (CID 103393572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).