1-[2-amino-4-[6-(piperidine-1-carbonyl)-3,4-dihydro-2H-1,8-naphthyridin-1-yl]-2H-pyridin-1-yl]-2-cyclopropylethanone

C24H31N5O2 — CID 166886381

IUPAC1-[2-amino-4-[6-(piperidine-1-carbonyl)-3,4-dihydro-2H-1,8-naphthyridin-1-yl]-2H-pyridin-1-yl]-2-cyclopropylethanone
SMILESNC1C=C(N2CCCc3cc(C(=O)N4CCCCC4)cnc32)C=CN1C(=O)CC1CC1
InChIInChI=1S/C24H31N5O2/c25-21-15-20(8-12-29(21)22(30)13-17-6-7-17)28-11-4-5-18-14-19(16-26-23(18)28)24(31)27-9-2-1-3-10-27/h8,12,14-17,21H,1-7,9-11,13,25H2
InChIKeyXAUZXFMDLLZSPF-UHFFFAOYSA-N
MW421.55 g/mol
LogP2.79
Rot. Bonds4

About 1-[2-amino-4-[6-(piperidine-1-carbonyl)-3,4-dihydro-2H-1,8-naphthyridin-1-yl]-2H-pyridin-1-yl]-2-cyclopropylethanone

1-[2-amino-4-[6-(piperidine-1-carbonyl)-3,4-dihydro-2H-1,8-naphthyridin-1-yl]-2H-pyridin-1-yl]-2-cyclopropylethanone (PubChem CID 166886381) has the molecular formula C24H31N5O2 and a molecular weight of 421.55 g/mol. Its IUPAC name is 1-[2-amino-4-[6-(piperidine-1-carbonyl)-3,4-dihydro-2H-1,8-naphthyridin-1-yl]-2H-pyridin-1-yl]-2-cyclopropylethanone.

Molecular Properties

Compound Name1-[2-amino-4-[6-(piperidine-1-carbonyl)-3,4-dihydro-2H-1,8-naphthyridin-1-yl]-2H-pyridin-1-yl]-2-cyclopropylethanone
PubChem CID166886381
Molecular FormulaC24H31N5O2
Molecular Weight421.55 g/mol
Exact Mass421.25
IUPAC Name1-[2-amino-4-[6-(piperidine-1-carbonyl)-3,4-dihydro-2H-1,8-naphthyridin-1-yl]-2H-pyridin-1-yl]-2-cyclopropylethanone
SMILESNC1C=C(N2CCCc3cc(C(=O)N4CCCCC4)cnc32)C=CN1C(=O)CC1CC1
InChIInChI=1S/C24H31N5O2/c25-21-15-20(8-12-29(21)22(30)13-17-6-7-17)28-11-4-5-18-14-19(16-26-23(18)28)24(31)27-9-2-1-3-10-27/h8,12,14-17,21H,1-7,9-11,13,25H2
InChIKeyXAUZXFMDLLZSPF-UHFFFAOYSA-N
XLogP2.79
TPSA82.77 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500421.55
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-[2-amino-4-[6-(piperidine-1-carbonyl)-3,4-dihydro-2H-1,8-naphthyridin-1-yl]-2H-pyridin-1-yl]-2-cyclopropylethanone with MolForge

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Related Compounds

7-butyl-4-[6-(pyrrolidine-1-carbonyl)-3,4-dihydro-2H-1,8-naphthyridin-1-yl]-1-azabicyclo[4.2.0]octa-2,4,6-trien-8-one
CID 166886374
4-[6-(piperidine-1-carbonyl)-3,4-dihydro-2H-1,8-naphthyridin-1-yl]benzoic acid
CID 154994854
4-[6-(piperidine-1-carbonyl)-3,4-dihydro-2H-1,8-naphthyridin-1-yl]benzenecarboximidamide
CID 166886356
2-[6-(piperidine-1-carbonyl)-3,4-dihydro-2H-1,8-naphthyridin-1-yl]benzoic acid
CID 154994962
2-(methylaminomethyl)-4-[7-(pyrrolidine-1-carbonyl)-2,3-dihydropyrido[3,2-b][1,4]oxazin-4-yl]-2H-pyridine-1-carbaldehyde
CID 154993990
[8-(4-methoxyphenyl)-6,7-dihydro-5H-1,8-naphthyridin-3-yl]-piperidin-1-ylmethanone
CID 154994822
[8-(3-ethyl-4-methylcyclohexa-1,3-dien-1-yl)-6,7-dihydro-5H-1,8-naphthyridin-3-yl]-piperidin-1-ylmethanone
CID 166887012
6-methyl-3-[6-(piperidine-1-carbonyl)-3,4-dihydro-2H-1,8-naphthyridin-1-yl]-5H-pyrrolo[3,4-b]pyridin-7-one
CID 167390377
2-[2-(oxetan-3-yl)ethyl]-5-[6-(piperidine-1-carbonyl)-3,4-dihydro-2H-1,8-naphthyridin-1-yl]-2,3-dihydroinden-1-one
CID 166887023
2-(2-methoxyethyl)-5-[6-(piperidine-1-carbonyl)-3,4-dihydro-2H-1,8-naphthyridin-1-yl]-2,3-dihydroinden-1-one
CID 166886458
2-(2-ethoxyethyl)-5-[6-(piperidine-1-carbonyl)-3,4-dihydro-2H-1,8-naphthyridin-1-yl]-2,3-dihydroinden-1-one
CID 166887007
2-[1-(6-methylpyridine-3-carbonyl)piperidin-4-yl]-1-pyrrolidin-1-ylethanone
CID 51082370

Frequently Asked Questions

What is the IUPAC name of 1-[2-amino-4-[6-(piperidine-1-carbonyl)-3,4-dihydro-2H-1,8-naphthyridin-1-yl]-2H-pyridin-1-yl]-2-cyclopropylethanone?
The IUPAC name of 1-[2-amino-4-[6-(piperidine-1-carbonyl)-3,4-dihydro-2H-1,8-naphthyridin-1-yl]-2H-pyridin-1-yl]-2-cyclopropylethanone (CID 166886381) is 1-[2-amino-4-[6-(piperidine-1-carbonyl)-3,4-dihydro-2H-1,8-naphthyridin-1-yl]-2H-pyridin-1-yl]-2-cyclopropylethanone.
What is the SMILES notation for 1-[2-amino-4-[6-(piperidine-1-carbonyl)-3,4-dihydro-2H-1,8-naphthyridin-1-yl]-2H-pyridin-1-yl]-2-cyclopropylethanone?
The canonical SMILES for 1-[2-amino-4-[6-(piperidine-1-carbonyl)-3,4-dihydro-2H-1,8-naphthyridin-1-yl]-2H-pyridin-1-yl]-2-cyclopropylethanone is NC1C=C(N2CCCc3cc(C(=O)N4CCCCC4)cnc32)C=CN1C(=O)CC1CC1.
What is the InChIKey of 1-[2-amino-4-[6-(piperidine-1-carbonyl)-3,4-dihydro-2H-1,8-naphthyridin-1-yl]-2H-pyridin-1-yl]-2-cyclopropylethanone?
The InChIKey is XAUZXFMDLLZSPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H31N5O2/c25-21-15-20(8-12-29(21)22(30)13-17-6-7-17)28-11-4-5-18-14-19(16-26-23(18)28)24(31)27-9-2-1-3-10-27/h8,12,14-17,21H,1-7,9-11,13,25H2.
What are the key properties of 1-[2-amino-4-[6-(piperidine-1-carbonyl)-3,4-dihydro-2H-1,8-naphthyridin-1-yl]-2H-pyridin-1-yl]-2-cyclopropylethanone?
1-[2-amino-4-[6-(piperidine-1-carbonyl)-3,4-dihydro-2H-1,8-naphthyridin-1-yl]-2H-pyridin-1-yl]-2-cyclopropylethanone has a molecular weight of 421.55 g/mol, XLogP of 2.79, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-amino-4-[6-(piperidine-1-carbonyl)-3,4-dihydro-2H-1,8-naphthyridin-1-yl]-2H-pyridin-1-yl]-2-cyclopropylethanone is sourced from PubChem (CID 166886381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).