tert-butyl 4-(7-methylfuro[3,2-c]pyridin-4-yl)piperazine-1-carboxylate

C17H23N3O3 — CID 67125779

IUPACtert-butyl 4-(7-methylfuro[3,2-c]pyridin-4-yl)piperazine-1-carboxylate
SMILESCc1cnc(N2CCN(C(=O)OC(C)(C)C)CC2)c2ccoc12
InChIInChI=1S/C17H23N3O3/c1-12-11-18-15(13-5-10-22-14(12)13)19-6-8-20(9-7-19)16(21)23-17(2,3)4/h5,10-11H,6-9H2,1-4H3
InChIKeyNXMWLMKOEXVWJO-UHFFFAOYSA-N
MW317.39 g/mol
LogP3.19
Rot. Bonds1

About tert-butyl 4-(7-methylfuro[3,2-c]pyridin-4-yl)piperazine-1-carboxylate

tert-butyl 4-(7-methylfuro[3,2-c]pyridin-4-yl)piperazine-1-carboxylate (PubChem CID 67125779) has the molecular formula C17H23N3O3 and a molecular weight of 317.39 g/mol. Its IUPAC name is tert-butyl 4-(7-methylfuro[3,2-c]pyridin-4-yl)piperazine-1-carboxylate.

Molecular Properties

Compound Nametert-butyl 4-(7-methylfuro[3,2-c]pyridin-4-yl)piperazine-1-carboxylate
PubChem CID67125779
Molecular FormulaC17H23N3O3
Molecular Weight317.39 g/mol
Exact Mass317.17
IUPAC Nametert-butyl 4-(7-methylfuro[3,2-c]pyridin-4-yl)piperazine-1-carboxylate
SMILESCc1cnc(N2CCN(C(=O)OC(C)(C)C)CC2)c2ccoc12
InChIInChI=1S/C17H23N3O3/c1-12-11-18-15(13-5-10-22-14(12)13)19-6-8-20(9-7-19)16(21)23-17(2,3)4/h5,10-11H,6-9H2,1-4H3
InChIKeyNXMWLMKOEXVWJO-UHFFFAOYSA-N
XLogP3.19
TPSA58.81 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze tert-butyl 4-(7-methylfuro[3,2-c]pyridin-4-yl)piperazine-1-carboxylate 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 4-(5-bromo-3-methyl-2-pyridinyl)piperazine-1-carboxylate
CID 46739269
tert-butyl 4-(3-bromo-4-methyl-2-pyridinyl)piperazine-1-carboxylate
CID 176508616
tert-butyl 4-(3-methoxy-2-pyridinyl)piperazine-1-carboxylate
CID 70571171
tert-butyl 4-(6-chloroisoquinolin-1-yl)piperazine-1-carboxylate
CID 176901250
tert-butyl 4-(6-bromothieno[2,3-d]pyrimidin-4-yl)piperazine-1-carboxylate
CID 21062855
tert-butyl 4-(5-bromo-1,2-benzoxazol-3-yl)piperazine-1-carboxylate
CID 139415832
tert-butyl 4-(4-methyl-3-pyridinyl)piperazine-1-carboxylate
CID 70570904
tert-butyl 4-(5-methoxypyrimidin-4-yl)piperazine-1-carboxylate
CID 156898070
tert-butyl 4-(3-methylimidazo[1,2-a]pyrazin-8-yl)piperazine-1-carboxylate
CID 10313750
tert-butyl 4-[6-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-2-pyridinyl]piperazine-1-carboxylate
CID 66693151
3-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]pyrazine-2-carboxylic acid
CID 169205005
tert-butyl 4-(5-iodo-6-methylpyrimidin-4-yl)piperazine-1-carboxylate
CID 156898021

Frequently Asked Questions

What is the IUPAC name of tert-butyl 4-(7-methylfuro[3,2-c]pyridin-4-yl)piperazine-1-carboxylate?
The IUPAC name of tert-butyl 4-(7-methylfuro[3,2-c]pyridin-4-yl)piperazine-1-carboxylate (CID 67125779) is tert-butyl 4-(7-methylfuro[3,2-c]pyridin-4-yl)piperazine-1-carboxylate.
What is the SMILES notation for tert-butyl 4-(7-methylfuro[3,2-c]pyridin-4-yl)piperazine-1-carboxylate?
The canonical SMILES for tert-butyl 4-(7-methylfuro[3,2-c]pyridin-4-yl)piperazine-1-carboxylate is Cc1cnc(N2CCN(C(=O)OC(C)(C)C)CC2)c2ccoc12.
What is the InChIKey of tert-butyl 4-(7-methylfuro[3,2-c]pyridin-4-yl)piperazine-1-carboxylate?
The InChIKey is NXMWLMKOEXVWJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O3/c1-12-11-18-15(13-5-10-22-14(12)13)19-6-8-20(9-7-19)16(21)23-17(2,3)4/h5,10-11H,6-9H2,1-4H3.
What are the key properties of tert-butyl 4-(7-methylfuro[3,2-c]pyridin-4-yl)piperazine-1-carboxylate?
tert-butyl 4-(7-methylfuro[3,2-c]pyridin-4-yl)piperazine-1-carboxylate has a molecular weight of 317.39 g/mol, XLogP of 3.19, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl 4-(7-methylfuro[3,2-c]pyridin-4-yl)piperazine-1-carboxylate is sourced from PubChem (CID 67125779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).