2-cyclopentyl-8-methyl-5,6,7,8-tetrahydro-1,6-naphthyridine

C14H20N2 — CID 59538730

IUPAC2-cyclopentyl-8-methyl-5,6,7,8-tetrahydro-1,6-naphthyridine
SMILESCC1CNCc2ccc(C3CCCC3)nc21
InChIInChI=1S/C14H20N2/c1-10-8-15-9-12-6-7-13(16-14(10)12)11-4-2-3-5-11/h6-7,10-11,15H,2-5,8-9H2,1H3
InChIKeyGMMPEMHIHQWBFE-UHFFFAOYSA-N
MW216.33 g/mol
LogP2.95
Rot. Bonds1

About 2-cyclopentyl-8-methyl-5,6,7,8-tetrahydro-1,6-naphthyridine

2-cyclopentyl-8-methyl-5,6,7,8-tetrahydro-1,6-naphthyridine (PubChem CID 59538730) has the molecular formula C14H20N2 and a molecular weight of 216.33 g/mol. Its IUPAC name is 2-cyclopentyl-8-methyl-5,6,7,8-tetrahydro-1,6-naphthyridine.

Molecular Properties

Compound Name2-cyclopentyl-8-methyl-5,6,7,8-tetrahydro-1,6-naphthyridine
PubChem CID59538730
Molecular FormulaC14H20N2
Molecular Weight216.33 g/mol
Exact Mass216.16
IUPAC Name2-cyclopentyl-8-methyl-5,6,7,8-tetrahydro-1,6-naphthyridine
SMILESCC1CNCc2ccc(C3CCCC3)nc21
InChIInChI=1S/C14H20N2/c1-10-8-15-9-12-6-7-13(16-14(10)12)11-4-2-3-5-11/h6-7,10-11,15H,2-5,8-9H2,1H3
InChIKeyGMMPEMHIHQWBFE-UHFFFAOYSA-N
XLogP2.95
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-8-methyl-5,6,7,8-tetrahydro-1,6-naphthyridine?
The IUPAC name of 2-cyclopentyl-8-methyl-5,6,7,8-tetrahydro-1,6-naphthyridine (CID 59538730) is 2-cyclopentyl-8-methyl-5,6,7,8-tetrahydro-1,6-naphthyridine.
What is the SMILES notation for 2-cyclopentyl-8-methyl-5,6,7,8-tetrahydro-1,6-naphthyridine?
The canonical SMILES for 2-cyclopentyl-8-methyl-5,6,7,8-tetrahydro-1,6-naphthyridine is CC1CNCc2ccc(C3CCCC3)nc21.
What is the InChIKey of 2-cyclopentyl-8-methyl-5,6,7,8-tetrahydro-1,6-naphthyridine?
The InChIKey is GMMPEMHIHQWBFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2/c1-10-8-15-9-12-6-7-13(16-14(10)12)11-4-2-3-5-11/h6-7,10-11,15H,2-5,8-9H2,1H3.
What are the key properties of 2-cyclopentyl-8-methyl-5,6,7,8-tetrahydro-1,6-naphthyridine?
2-cyclopentyl-8-methyl-5,6,7,8-tetrahydro-1,6-naphthyridine has a molecular weight of 216.33 g/mol, XLogP of 2.95, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-8-methyl-5,6,7,8-tetrahydro-1,6-naphthyridine is sourced from PubChem (CID 59538730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).