1-(7-bromo-1,5-naphthyridin-4-yl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide

C20H20BrN5O — CID 133482515

IUPAC1-(7-bromo-1,5-naphthyridin-4-yl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide
SMILESO=C(NCc1cccnc1)C1CCN(c2ccnc3cc(Br)cnc23)CC1
InChIInChI=1S/C20H20BrN5O/c21-16-10-17-19(24-13-16)18(3-7-23-17)26-8-4-15(5-9-26)20(27)25-12-14-2-1-6-22-11-14/h1-3,6-7,10-11,13,15H,4-5,8-9,12H2,(H,25,27)
InChIKeyHRAWZEPNFVWDBZ-UHFFFAOYSA-N
MW426.32 g/mol
LogP3.32
Rot. Bonds4

About 1-(7-bromo-1,5-naphthyridin-4-yl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide

1-(7-bromo-1,5-naphthyridin-4-yl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide (PubChem CID 133482515) has the molecular formula C20H20BrN5O and a molecular weight of 426.32 g/mol. Its IUPAC name is 1-(7-bromo-1,5-naphthyridin-4-yl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(7-bromo-1,5-naphthyridin-4-yl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide
PubChem CID133482515
Molecular FormulaC20H20BrN5O
Molecular Weight426.32 g/mol
Exact Mass425.09
IUPAC Name1-(7-bromo-1,5-naphthyridin-4-yl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide
SMILESO=C(NCc1cccnc1)C1CCN(c2ccnc3cc(Br)cnc23)CC1
InChIInChI=1S/C20H20BrN5O/c21-16-10-17-19(24-13-16)18(3-7-23-17)26-8-4-15(5-9-26)20(27)25-12-14-2-1-6-22-11-14/h1-3,6-7,10-11,13,15H,4-5,8-9,12H2,(H,25,27)
InChIKeyHRAWZEPNFVWDBZ-UHFFFAOYSA-N
XLogP3.32
TPSA71.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.32
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-bromo-N-[(4-fluorophenyl)methyl]-8-(piperidin-4-ylamino)-1,6-naphthyridine-7-carboxamide
CID 45376447
N-[(6-fluoro-3-pyridinyl)methyl]-6-[4-(2-pyridin-4-yl-3-pyridinyl)piperazin-1-yl]hexanamide
CID 76284725
8-[(4-aminocyclohexyl)amino]-5-bromo-N-(pyridin-2-ylmethyl)-1,6-naphthyridine-7-carboxamide
CID 71459201
5-bromo-N-[(4-fluorophenyl)methyl]-8-piperazin-1-yl-1,6-naphthyridine-7-carboxamide
CID 71459220
US11458138, Example 292
CID 135368670
US20250042857, Example B-4
CID 169683129
US10251893, Cpd 157
CID 46927293
N-[[1-(6-bromoquinolin-4-yl)piperidin-4-yl]methyl]acetamide
CID 51130776
N-(pyridin-2-ylmethyl)-2-(4-quinolin-4-ylpiperazin-1-yl)acetamide
CID 134147954
2-[[2-(4-Bromophenyl)-3-cyano-1,7-naphthyridin-4-yl]amino]acetamide
CID 171346003
2-[[2-(4-Bromophenyl)-3-cyano-1,7-naphthyridin-4-yl]amino]propanamide
CID 171347333
(2R)-2-[[2-(4-bromophenyl)-3-cyano-1,7-naphthyridin-4-yl]amino]butanamide
CID 171351839

Frequently Asked Questions

What is the IUPAC name of 1-(7-bromo-1,5-naphthyridin-4-yl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide?
The IUPAC name of 1-(7-bromo-1,5-naphthyridin-4-yl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide (CID 133482515) is 1-(7-bromo-1,5-naphthyridin-4-yl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(7-bromo-1,5-naphthyridin-4-yl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(7-bromo-1,5-naphthyridin-4-yl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide is O=C(NCc1cccnc1)C1CCN(c2ccnc3cc(Br)cnc23)CC1.
What is the InChIKey of 1-(7-bromo-1,5-naphthyridin-4-yl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide?
The InChIKey is HRAWZEPNFVWDBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20BrN5O/c21-16-10-17-19(24-13-16)18(3-7-23-17)26-8-4-15(5-9-26)20(27)25-12-14-2-1-6-22-11-14/h1-3,6-7,10-11,13,15H,4-5,8-9,12H2,(H,25,27).
What are the key properties of 1-(7-bromo-1,5-naphthyridin-4-yl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide?
1-(7-bromo-1,5-naphthyridin-4-yl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide has a molecular weight of 426.32 g/mol, XLogP of 3.32, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-bromo-1,5-naphthyridin-4-yl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide is sourced from PubChem (CID 133482515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).