2-cyclopentyl-5,6,7,8-tetrahydro-1,7-naphthyridine-4-carboxylic acid

C14H18N2O2 — CID 82384369

IUPAC2-cyclopentyl-5,6,7,8-tetrahydro-1,7-naphthyridine-4-carboxylic acid
SMILESO=C(O)c1cc(C2CCCC2)nc2c1CCNC2
InChIInChI=1S/C14H18N2O2/c17-14(18)11-7-12(9-3-1-2-4-9)16-13-8-15-6-5-10(11)13/h7,9,15H,1-6,8H2,(H,17,18)
InChIKeySFALMXQPTGKGQJ-UHFFFAOYSA-N
MW246.31 g/mol
LogP2.08
Rot. Bonds2

About 2-cyclopentyl-5,6,7,8-tetrahydro-1,7-naphthyridine-4-carboxylic acid

2-cyclopentyl-5,6,7,8-tetrahydro-1,7-naphthyridine-4-carboxylic acid (PubChem CID 82384369) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is 2-cyclopentyl-5,6,7,8-tetrahydro-1,7-naphthyridine-4-carboxylic acid.

Molecular Properties

Compound Name2-cyclopentyl-5,6,7,8-tetrahydro-1,7-naphthyridine-4-carboxylic acid
PubChem CID82384369
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC Name2-cyclopentyl-5,6,7,8-tetrahydro-1,7-naphthyridine-4-carboxylic acid
SMILESO=C(O)c1cc(C2CCCC2)nc2c1CCNC2
InChIInChI=1S/C14H18N2O2/c17-14(18)11-7-12(9-3-1-2-4-9)16-13-8-15-6-5-10(11)13/h7,9,15H,1-6,8H2,(H,17,18)
InChIKeySFALMXQPTGKGQJ-UHFFFAOYSA-N
XLogP2.08
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopentyl-6,8-dihydro-5H-pyrano[3,4-b]pyridine-4-carboxylic acid
CID 82383955
2-piperidin-4-ylquinoline-4-carboxylic acid
CID 84635932
6-ethyl-2-piperidin-4-ylquinoline-4-carboxylic acid
CID 84643398
7-bromo-2-cyclohexylquinoline-4-carboxylic acid
CID 43805508
6-methoxy-2-piperidin-4-ylquinoline-4-carboxylic acid
CID 84643635
2-cyclohexyl-8-fluoroquinoline-4-carboxylic acid
CID 3872421
2-cyclopentyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridine-3-carboxylic acid
CID 105496410
2-cyclopentyl-8-ethylquinoline-4-carboxylic acid
CID 4985765
2-(cyclopropylamino)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine-4-carboxylic acid
CID 114743097
6-cyclohexyl-2-methylpyrimidine-4-carboxylic acid
CID 83822396
2-cyclopentyl-N-methyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-amine
CID 105491818
7-fluoro-2-pyrrolidin-3-ylquinoline-4-carboxylic acid
CID 84638041

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-5,6,7,8-tetrahydro-1,7-naphthyridine-4-carboxylic acid?
The IUPAC name of 2-cyclopentyl-5,6,7,8-tetrahydro-1,7-naphthyridine-4-carboxylic acid (CID 82384369) is 2-cyclopentyl-5,6,7,8-tetrahydro-1,7-naphthyridine-4-carboxylic acid.
What is the SMILES notation for 2-cyclopentyl-5,6,7,8-tetrahydro-1,7-naphthyridine-4-carboxylic acid?
The canonical SMILES for 2-cyclopentyl-5,6,7,8-tetrahydro-1,7-naphthyridine-4-carboxylic acid is O=C(O)c1cc(C2CCCC2)nc2c1CCNC2.
What is the InChIKey of 2-cyclopentyl-5,6,7,8-tetrahydro-1,7-naphthyridine-4-carboxylic acid?
The InChIKey is SFALMXQPTGKGQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c17-14(18)11-7-12(9-3-1-2-4-9)16-13-8-15-6-5-10(11)13/h7,9,15H,1-6,8H2,(H,17,18).
What are the key properties of 2-cyclopentyl-5,6,7,8-tetrahydro-1,7-naphthyridine-4-carboxylic acid?
2-cyclopentyl-5,6,7,8-tetrahydro-1,7-naphthyridine-4-carboxylic acid has a molecular weight of 246.31 g/mol, XLogP of 2.08, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-5,6,7,8-tetrahydro-1,7-naphthyridine-4-carboxylic acid is sourced from PubChem (CID 82384369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).