6-methoxy-2-(5-methylfuran-2-yl)-N-(1-methylpiperidin-4-yl)-7-piperidin-4-yloxyquinolin-4-amine

C26H34N4O3 — CID 129085369

IUPAC6-methoxy-2-(5-methylfuran-2-yl)-N-(1-methylpiperidin-4-yl)-7-piperidin-4-yloxyquinolin-4-amine
SMILESCOc1cc2c(NC3CCN(C)CC3)cc(-c3ccc(C)o3)nc2cc1OC1CCNCC1
InChIInChI=1S/C26H34N4O3/c1-17-4-5-24(32-17)23-15-21(28-18-8-12-30(2)13-9-18)20-14-25(31-3)26(16-22(20)29-23)33-19-6-10-27-11-7-19/h4-5,14-16,18-19,27H,6-13H2,1-3H3,(H,28,29)
InChIKeyKHOPFPLBBABLFV-UHFFFAOYSA-N
MW450.58 g/mol
LogP4.45
Rot. Bonds6

About 6-methoxy-2-(5-methylfuran-2-yl)-N-(1-methylpiperidin-4-yl)-7-piperidin-4-yloxyquinolin-4-amine

6-methoxy-2-(5-methylfuran-2-yl)-N-(1-methylpiperidin-4-yl)-7-piperidin-4-yloxyquinolin-4-amine (PubChem CID 129085369) has the molecular formula C26H34N4O3 and a molecular weight of 450.58 g/mol. Its IUPAC name is 6-methoxy-2-(5-methylfuran-2-yl)-N-(1-methylpiperidin-4-yl)-7-piperidin-4-yloxyquinolin-4-amine.

Molecular Properties

Compound Name6-methoxy-2-(5-methylfuran-2-yl)-N-(1-methylpiperidin-4-yl)-7-piperidin-4-yloxyquinolin-4-amine
PubChem CID129085369
Molecular FormulaC26H34N4O3
Molecular Weight450.58 g/mol
Exact Mass450.26
IUPAC Name6-methoxy-2-(5-methylfuran-2-yl)-N-(1-methylpiperidin-4-yl)-7-piperidin-4-yloxyquinolin-4-amine
SMILESCOc1cc2c(NC3CCN(C)CC3)cc(-c3ccc(C)o3)nc2cc1OC1CCNCC1
InChIInChI=1S/C26H34N4O3/c1-17-4-5-24(32-17)23-15-21(28-18-8-12-30(2)13-9-18)20-14-25(31-3)26(16-22(20)29-23)33-19-6-10-27-11-7-19/h4-5,14-16,18-19,27H,6-13H2,1-3H3,(H,28,29)
InChIKeyKHOPFPLBBABLFV-UHFFFAOYSA-N
XLogP4.45
TPSA71.79 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500450.58
LogP ≤ 54.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 6-methoxy-2-(5-methylfuran-2-yl)-N-(1-methylpiperidin-4-yl)-7-piperidin-4-yloxyquinolin-4-amine with MolForge

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Related Compounds

6-Methoxy-2-(5-methylfuran-2-yl)-N-(1-methylpiperidin-4-yl)-7-(3-(pyrrolidin-1-yl)propoxy)quinolin-4-amine
CID 118607432
N-(2-furylmethyl)-N'-[7-(2-methoxyphenoxy)-4-quinolyl]propane-1,3-diamine
CID 56595010
2-cyclohexyl-6-methoxy-N-(1-propan-2-ylpiperidin-4-yl)-7-(3-pyrrolidin-1-ylpropoxy)quinolin-4-amine
CID 118607414
Quinostatin
CID 6620134
2-(3,4-dimethoxyphenyl)-N-(2-furylmethyl)-4-quinolinecarboxamide
CID 1009671
1,2-Ethanediamine, N'-(2-(2-furanyl)-4-quinolinyl)-N,N-dimethyl-
CID 453072
4-(4-Furan-3-ylmethyl-phenylamino)-6-methoxy-7-(3-morpholin-4-yl-propoxy)-quinoline-3-carbonitrile
CID 10185285
4-(4-Furan-2-ylmethyl-phenylamino)-6-methoxy-7-(3-morpholin-4-yl-propoxy)-quinoline-3-carbonitrile
CID 10228676
6-methoxy-2-(5-methylfuran-2-yl)-N-(1-methylpiperidin-4-yl)-7-(piperidin-4-ylmethoxy)quinolin-4-amine
CID 118607373
6-methoxy-N-(1-methylpiperidin-4-yl)-2-(oxan-4-yl)-7-(3-pyrrolidin-1-ylpropoxy)quinolin-4-amine
CID 118607435
6,7-dimethoxy-2-(5-methylfuran-2-yl)-N-(1-methylpiperidin-4-yl)quinolin-4-amine
CID 118607459
2-(5-Methylfuran-2-yl)-4-[(1-methylpiperidin-4-yl)amino]-7-(3-pyrrolidin-1-ylpropoxy)quinolin-6-ol
CID 118607465

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-(5-methylfuran-2-yl)-N-(1-methylpiperidin-4-yl)-7-piperidin-4-yloxyquinolin-4-amine?
The IUPAC name of 6-methoxy-2-(5-methylfuran-2-yl)-N-(1-methylpiperidin-4-yl)-7-piperidin-4-yloxyquinolin-4-amine (CID 129085369) is 6-methoxy-2-(5-methylfuran-2-yl)-N-(1-methylpiperidin-4-yl)-7-piperidin-4-yloxyquinolin-4-amine.
What is the SMILES notation for 6-methoxy-2-(5-methylfuran-2-yl)-N-(1-methylpiperidin-4-yl)-7-piperidin-4-yloxyquinolin-4-amine?
The canonical SMILES for 6-methoxy-2-(5-methylfuran-2-yl)-N-(1-methylpiperidin-4-yl)-7-piperidin-4-yloxyquinolin-4-amine is COc1cc2c(NC3CCN(C)CC3)cc(-c3ccc(C)o3)nc2cc1OC1CCNCC1.
What is the InChIKey of 6-methoxy-2-(5-methylfuran-2-yl)-N-(1-methylpiperidin-4-yl)-7-piperidin-4-yloxyquinolin-4-amine?
The InChIKey is KHOPFPLBBABLFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H34N4O3/c1-17-4-5-24(32-17)23-15-21(28-18-8-12-30(2)13-9-18)20-14-25(31-3)26(16-22(20)29-23)33-19-6-10-27-11-7-19/h4-5,14-16,18-19,27H,6-13H2,1-3H3,(H,28,29).
What are the key properties of 6-methoxy-2-(5-methylfuran-2-yl)-N-(1-methylpiperidin-4-yl)-7-piperidin-4-yloxyquinolin-4-amine?
6-methoxy-2-(5-methylfuran-2-yl)-N-(1-methylpiperidin-4-yl)-7-piperidin-4-yloxyquinolin-4-amine has a molecular weight of 450.58 g/mol, XLogP of 4.45, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-(5-methylfuran-2-yl)-N-(1-methylpiperidin-4-yl)-7-piperidin-4-yloxyquinolin-4-amine is sourced from PubChem (CID 129085369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).