6-(6-methyl-3-pyridinyl)-2-(1-propan-2-ylpiperidin-4-yl)oxy-7,8-dihydro-5H-1,6-naphthyridine

C22H30N4O — CID 11501507

IUPAC6-(6-methyl-3-pyridinyl)-2-(1-propan-2-ylpiperidin-4-yl)oxy-7,8-dihydro-5H-1,6-naphthyridine
SMILESCc1ccc(N2CCc3nc(OC4CCN(C(C)C)CC4)ccc3C2)cn1
InChIInChI=1S/C22H30N4O/c1-16(2)25-11-8-20(9-12-25)27-22-7-5-18-15-26(13-10-21(18)24-22)19-6-4-17(3)23-14-19/h4-7,14,16,20H,8-13,15H2,1-3H3
InChIKeyMYLUKNJGRVNPLR-UHFFFAOYSA-N
MW366.51 g/mol
LogP3.60
Rot. Bonds4

About 6-(6-methyl-3-pyridinyl)-2-(1-propan-2-ylpiperidin-4-yl)oxy-7,8-dihydro-5H-1,6-naphthyridine

6-(6-methyl-3-pyridinyl)-2-(1-propan-2-ylpiperidin-4-yl)oxy-7,8-dihydro-5H-1,6-naphthyridine (PubChem CID 11501507) has the molecular formula C22H30N4O and a molecular weight of 366.51 g/mol. Its IUPAC name is 6-(6-methyl-3-pyridinyl)-2-(1-propan-2-ylpiperidin-4-yl)oxy-7,8-dihydro-5H-1,6-naphthyridine.

Molecular Properties

Compound Name6-(6-methyl-3-pyridinyl)-2-(1-propan-2-ylpiperidin-4-yl)oxy-7,8-dihydro-5H-1,6-naphthyridine
PubChem CID11501507
Molecular FormulaC22H30N4O
Molecular Weight366.51 g/mol
Exact Mass366.24
IUPAC Name6-(6-methyl-3-pyridinyl)-2-(1-propan-2-ylpiperidin-4-yl)oxy-7,8-dihydro-5H-1,6-naphthyridine
SMILESCc1ccc(N2CCc3nc(OC4CCN(C(C)C)CC4)ccc3C2)cn1
InChIInChI=1S/C22H30N4O/c1-16(2)25-11-8-20(9-12-25)27-22-7-5-18-15-26(13-10-21(18)24-22)19-6-4-17(3)23-14-19/h4-7,14,16,20H,8-13,15H2,1-3H3
InChIKeyMYLUKNJGRVNPLR-UHFFFAOYSA-N
XLogP3.60
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.51
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(6-methyl-3-pyridinyl)-2-(1-propan-2-ylpiperidin-4-yl)oxy-7,8-dihydro-5H-1,6-naphthyridine?
The IUPAC name of 6-(6-methyl-3-pyridinyl)-2-(1-propan-2-ylpiperidin-4-yl)oxy-7,8-dihydro-5H-1,6-naphthyridine (CID 11501507) is 6-(6-methyl-3-pyridinyl)-2-(1-propan-2-ylpiperidin-4-yl)oxy-7,8-dihydro-5H-1,6-naphthyridine.
What is the SMILES notation for 6-(6-methyl-3-pyridinyl)-2-(1-propan-2-ylpiperidin-4-yl)oxy-7,8-dihydro-5H-1,6-naphthyridine?
The canonical SMILES for 6-(6-methyl-3-pyridinyl)-2-(1-propan-2-ylpiperidin-4-yl)oxy-7,8-dihydro-5H-1,6-naphthyridine is Cc1ccc(N2CCc3nc(OC4CCN(C(C)C)CC4)ccc3C2)cn1.
What is the InChIKey of 6-(6-methyl-3-pyridinyl)-2-(1-propan-2-ylpiperidin-4-yl)oxy-7,8-dihydro-5H-1,6-naphthyridine?
The InChIKey is MYLUKNJGRVNPLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30N4O/c1-16(2)25-11-8-20(9-12-25)27-22-7-5-18-15-26(13-10-21(18)24-22)19-6-4-17(3)23-14-19/h4-7,14,16,20H,8-13,15H2,1-3H3.
What are the key properties of 6-(6-methyl-3-pyridinyl)-2-(1-propan-2-ylpiperidin-4-yl)oxy-7,8-dihydro-5H-1,6-naphthyridine?
6-(6-methyl-3-pyridinyl)-2-(1-propan-2-ylpiperidin-4-yl)oxy-7,8-dihydro-5H-1,6-naphthyridine has a molecular weight of 366.51 g/mol, XLogP of 3.60, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(6-methyl-3-pyridinyl)-2-(1-propan-2-ylpiperidin-4-yl)oxy-7,8-dihydro-5H-1,6-naphthyridine is sourced from PubChem (CID 11501507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).