tert-butyl N-[1-[1-hydroxy-2-[(1-methylpyrazol-3-yl)amino]-2-oxoethyl]cyclobutyl]carbamate

C15H24N4O4 — CID 67230308

IUPACtert-butyl N-[1-[1-hydroxy-2-[(1-methylpyrazol-3-yl)amino]-2-oxoethyl]cyclobutyl]carbamate
SMILESCn1ccc(NC(=O)C(O)C2(NC(=O)OC(C)(C)C)CCC2)n1
InChIInChI=1S/C15H24N4O4/c1-14(2,3)23-13(22)17-15(7-5-8-15)11(20)12(21)16-10-6-9-19(4)18-10/h6,9,11,20H,5,7-8H2,1-4H3,(H,17,22)(H,16,18,21)
InChIKeyNYPOIIQTZKZKQX-UHFFFAOYSA-N
MW324.38 g/mol
LogP1.17
Rot. Bonds4

About tert-butyl N-[1-[1-hydroxy-2-[(1-methylpyrazol-3-yl)amino]-2-oxoethyl]cyclobutyl]carbamate

tert-butyl N-[1-[1-hydroxy-2-[(1-methylpyrazol-3-yl)amino]-2-oxoethyl]cyclobutyl]carbamate (PubChem CID 67230308) has the molecular formula C15H24N4O4 and a molecular weight of 324.38 g/mol. Its IUPAC name is tert-butyl N-[1-[1-hydroxy-2-[(1-methylpyrazol-3-yl)amino]-2-oxoethyl]cyclobutyl]carbamate.

Molecular Properties

Compound Nametert-butyl N-[1-[1-hydroxy-2-[(1-methylpyrazol-3-yl)amino]-2-oxoethyl]cyclobutyl]carbamate
PubChem CID67230308
Molecular FormulaC15H24N4O4
Molecular Weight324.38 g/mol
Exact Mass324.18
IUPAC Nametert-butyl N-[1-[1-hydroxy-2-[(1-methylpyrazol-3-yl)amino]-2-oxoethyl]cyclobutyl]carbamate
SMILESCn1ccc(NC(=O)C(O)C2(NC(=O)OC(C)(C)C)CCC2)n1
InChIInChI=1S/C15H24N4O4/c1-14(2,3)23-13(22)17-15(7-5-8-15)11(20)12(21)16-10-6-9-19(4)18-10/h6,9,11,20H,5,7-8H2,1-4H3,(H,17,22)(H,16,18,21)
InChIKeyNYPOIIQTZKZKQX-UHFFFAOYSA-N
XLogP1.17
TPSA105.48 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 51.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze tert-butyl N-[1-[1-hydroxy-2-[(1-methylpyrazol-3-yl)amino]-2-oxoethyl]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

tert-butyl N-[1-[1-hydroxy-2-[(1-methylpyrazol-3-yl)amino]-2-oxoethyl]-3-methoxycyclobutyl]carbamate
CID 67237770
tert-butyl N-[1-[1-hydroxy-2-[(1-methylpyrazol-3-yl)amino]-2-oxoethyl]-3-(3-methoxypropyl)cyclobutyl]carbamate
CID 123631023
2-amino-3-(1-fluorocyclopentyl)-N-[1-[1-hydroxy-2-[(1-methylpyrazol-3-yl)amino]-2-oxoethyl]cyclobutyl]propanamide
CID 71073366
tert-butyl N-[(2S)-3-(1-fluorocyclopentyl)-1-[[1-[2-[(1-methylpyrazol-3-yl)amino]-2-oxoacetyl]cyclopropyl]amino]-1-oxopropan-2-yl]carbamate
CID 71476849
methyl N-(1-methylpyrazol-3-yl)carbamate
CID 12774707
tert-butyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-[(1-methylpyrazol-3-yl)amino]-4-oxobutanoate
CID 118061279
tert-butyl N-[1-[2-(cyclopropylamino)-1-hydroxy-2-oxoethyl]cyclopropyl]carbamate
CID 67385903
tert-butyl N-[(2S)-1-[[3,3-difluoro-1-[2-[(1-methylpyrazol-3-yl)amino]-2-oxoacetyl]cyclobutyl]amino]-4-fluoro-4-methyl-1-oxohexan-2-yl]carbamate
CID 53258913
tert-butyl N-[1-(1-methylpyrazol-3-yl)ethyl]carbamate
CID 130470626
tert-butyl 3-[(1-methylpyrazol-3-yl)carbamoyl]piperidine-1-carboxylate
CID 18152683
tert-butyl N-[1-(1-hydroxy-2-methylpropyl)cyclopropyl]carbamate
CID 167733960
2-bromo-3-methyl-N-(1-methylpyrazol-3-yl)butanamide
CID 60810457

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[1-[1-hydroxy-2-[(1-methylpyrazol-3-yl)amino]-2-oxoethyl]cyclobutyl]carbamate?
The IUPAC name of tert-butyl N-[1-[1-hydroxy-2-[(1-methylpyrazol-3-yl)amino]-2-oxoethyl]cyclobutyl]carbamate (CID 67230308) is tert-butyl N-[1-[1-hydroxy-2-[(1-methylpyrazol-3-yl)amino]-2-oxoethyl]cyclobutyl]carbamate.
What is the SMILES notation for tert-butyl N-[1-[1-hydroxy-2-[(1-methylpyrazol-3-yl)amino]-2-oxoethyl]cyclobutyl]carbamate?
The canonical SMILES for tert-butyl N-[1-[1-hydroxy-2-[(1-methylpyrazol-3-yl)amino]-2-oxoethyl]cyclobutyl]carbamate is Cn1ccc(NC(=O)C(O)C2(NC(=O)OC(C)(C)C)CCC2)n1.
What is the InChIKey of tert-butyl N-[1-[1-hydroxy-2-[(1-methylpyrazol-3-yl)amino]-2-oxoethyl]cyclobutyl]carbamate?
The InChIKey is NYPOIIQTZKZKQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O4/c1-14(2,3)23-13(22)17-15(7-5-8-15)11(20)12(21)16-10-6-9-19(4)18-10/h6,9,11,20H,5,7-8H2,1-4H3,(H,17,22)(H,16,18,21).
What are the key properties of tert-butyl N-[1-[1-hydroxy-2-[(1-methylpyrazol-3-yl)amino]-2-oxoethyl]cyclobutyl]carbamate?
tert-butyl N-[1-[1-hydroxy-2-[(1-methylpyrazol-3-yl)amino]-2-oxoethyl]cyclobutyl]carbamate has a molecular weight of 324.38 g/mol, XLogP of 1.17, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[1-[1-hydroxy-2-[(1-methylpyrazol-3-yl)amino]-2-oxoethyl]cyclobutyl]carbamate is sourced from PubChem (CID 67230308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).