4-[4-(3-amino-5-methylpiperidin-1-yl)-3-pyridinyl]-6-methyl-2H-furo[3,2-b]pyridin-2-amine

C19H25N5O — CID 141444612

IUPAC4-[4-(3-amino-5-methylpiperidin-1-yl)-3-pyridinyl]-6-methyl-2H-furo[3,2-b]pyridin-2-amine
SMILESCC1=CN(c2cnccc2N2CC(C)CC(N)C2)C2=CC(N)OC2=C1
InChIInChI=1S/C19H25N5O/c1-12-5-14(20)11-23(9-12)15-3-4-22-8-17(15)24-10-13(2)6-18-16(24)7-19(21)25-18/h3-4,6-8,10,12,14,19H,5,9,11,20-21H2,1-2H3
InChIKeyTVUCBPABJOSDEH-UHFFFAOYSA-N
MW339.44 g/mol
LogP2.06
Rot. Bonds2

About 4-[4-(3-amino-5-methylpiperidin-1-yl)-3-pyridinyl]-6-methyl-2H-furo[3,2-b]pyridin-2-amine

4-[4-(3-amino-5-methylpiperidin-1-yl)-3-pyridinyl]-6-methyl-2H-furo[3,2-b]pyridin-2-amine (PubChem CID 141444612) has the molecular formula C19H25N5O and a molecular weight of 339.44 g/mol. Its IUPAC name is 4-[4-(3-amino-5-methylpiperidin-1-yl)-3-pyridinyl]-6-methyl-2H-furo[3,2-b]pyridin-2-amine.

Molecular Properties

Compound Name4-[4-(3-amino-5-methylpiperidin-1-yl)-3-pyridinyl]-6-methyl-2H-furo[3,2-b]pyridin-2-amine
PubChem CID141444612
Molecular FormulaC19H25N5O
Molecular Weight339.44 g/mol
Exact Mass339.21
IUPAC Name4-[4-(3-amino-5-methylpiperidin-1-yl)-3-pyridinyl]-6-methyl-2H-furo[3,2-b]pyridin-2-amine
SMILESCC1=CN(c2cnccc2N2CC(C)CC(N)C2)C2=CC(N)OC2=C1
InChIInChI=1S/C19H25N5O/c1-12-5-14(20)11-23(9-12)15-3-4-22-8-17(15)24-10-13(2)6-18-16(24)7-19(21)25-18/h3-4,6-8,10,12,14,19H,5,9,11,20-21H2,1-2H3
InChIKeyTVUCBPABJOSDEH-UHFFFAOYSA-N
XLogP2.06
TPSA80.64 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-[4-(3-amino-5-methylpiperidin-1-yl)-3-pyridinyl]-6-methyl-2H-furo[3,2-b]pyridin-2-amine?
The IUPAC name of 4-[4-(3-amino-5-methylpiperidin-1-yl)-3-pyridinyl]-6-methyl-2H-furo[3,2-b]pyridin-2-amine (CID 141444612) is 4-[4-(3-amino-5-methylpiperidin-1-yl)-3-pyridinyl]-6-methyl-2H-furo[3,2-b]pyridin-2-amine.
What is the SMILES notation for 4-[4-(3-amino-5-methylpiperidin-1-yl)-3-pyridinyl]-6-methyl-2H-furo[3,2-b]pyridin-2-amine?
The canonical SMILES for 4-[4-(3-amino-5-methylpiperidin-1-yl)-3-pyridinyl]-6-methyl-2H-furo[3,2-b]pyridin-2-amine is CC1=CN(c2cnccc2N2CC(C)CC(N)C2)C2=CC(N)OC2=C1.
What is the InChIKey of 4-[4-(3-amino-5-methylpiperidin-1-yl)-3-pyridinyl]-6-methyl-2H-furo[3,2-b]pyridin-2-amine?
The InChIKey is TVUCBPABJOSDEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O/c1-12-5-14(20)11-23(9-12)15-3-4-22-8-17(15)24-10-13(2)6-18-16(24)7-19(21)25-18/h3-4,6-8,10,12,14,19H,5,9,11,20-21H2,1-2H3.
What are the key properties of 4-[4-(3-amino-5-methylpiperidin-1-yl)-3-pyridinyl]-6-methyl-2H-furo[3,2-b]pyridin-2-amine?
4-[4-(3-amino-5-methylpiperidin-1-yl)-3-pyridinyl]-6-methyl-2H-furo[3,2-b]pyridin-2-amine has a molecular weight of 339.44 g/mol, XLogP of 2.06, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(3-amino-5-methylpiperidin-1-yl)-3-pyridinyl]-6-methyl-2H-furo[3,2-b]pyridin-2-amine is sourced from PubChem (CID 141444612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).