7-fluoro-1-[2-[4-methyl-4-(pyridin-3-ylmethylamino)piperidin-1-yl]ethyl]-1,5-naphthyridin-2-one

C22H26FN5O — CID 69281843

IUPAC7-fluoro-1-[2-[4-methyl-4-(pyridin-3-ylmethylamino)piperidin-1-yl]ethyl]-1,5-naphthyridin-2-one
SMILESCC1(NCc2cccnc2)CCN(CCn2c(=O)ccc3ncc(F)cc32)CC1
InChIInChI=1S/C22H26FN5O/c1-22(26-15-17-3-2-8-24-14-17)6-9-27(10-7-22)11-12-28-20-13-18(23)16-25-19(20)4-5-21(28)29/h2-5,8,13-14,16,26H,6-7,9-12,15H2,1H3
InChIKeyAUIDBSSLPIUTEI-UHFFFAOYSA-N
MW395.48 g/mol
LogP2.57
Rot. Bonds6

About 7-fluoro-1-[2-[4-methyl-4-(pyridin-3-ylmethylamino)piperidin-1-yl]ethyl]-1,5-naphthyridin-2-one

7-fluoro-1-[2-[4-methyl-4-(pyridin-3-ylmethylamino)piperidin-1-yl]ethyl]-1,5-naphthyridin-2-one (PubChem CID 69281843) has the molecular formula C22H26FN5O and a molecular weight of 395.48 g/mol. Its IUPAC name is 7-fluoro-1-[2-[4-methyl-4-(pyridin-3-ylmethylamino)piperidin-1-yl]ethyl]-1,5-naphthyridin-2-one.

Molecular Properties

Compound Name7-fluoro-1-[2-[4-methyl-4-(pyridin-3-ylmethylamino)piperidin-1-yl]ethyl]-1,5-naphthyridin-2-one
PubChem CID69281843
Molecular FormulaC22H26FN5O
Molecular Weight395.48 g/mol
Exact Mass395.21
IUPAC Name7-fluoro-1-[2-[4-methyl-4-(pyridin-3-ylmethylamino)piperidin-1-yl]ethyl]-1,5-naphthyridin-2-one
SMILESCC1(NCc2cccnc2)CCN(CCn2c(=O)ccc3ncc(F)cc32)CC1
InChIInChI=1S/C22H26FN5O/c1-22(26-15-17-3-2-8-24-14-17)6-9-27(10-7-22)11-12-28-20-13-18(23)16-25-19(20)4-5-21(28)29/h2-5,8,13-14,16,26H,6-7,9-12,15H2,1H3
InChIKeyAUIDBSSLPIUTEI-UHFFFAOYSA-N
XLogP2.57
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.48
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 7-fluoro-1-[2-[4-methyl-4-(pyridin-3-ylmethylamino)piperidin-1-yl]ethyl]-1,5-naphthyridin-2-one with MolForge

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Launch Full Analysis

Related Compounds

1-[2-[4-[(2-bromo-1,3-thiazol-5-yl)methylamino]piperidin-1-yl]ethyl]-7-fluoro-1,5-naphthyridin-2-one
CID 68854843
1-[2-[4-[2-(5-chloro-6-methyl-3-pyridinyl)ethyl]piperidin-1-yl]ethyl]-7-fluoro-1,5-naphthyridin-2-one
CID 58579445
1-[1-[2-(7-fluoro-2-oxo-1,5-naphthyridin-1-yl)ethyl]piperidin-4-yl]-3-(4-fluorophenyl)urea
CID 118712934
5-ethyl-3-fluoro-2-methylpyridine;7-fluoro-1-[2-(3-hydroxy-4-methylpiperidin-1-yl)ethyl]-1,5-naphthyridin-2-one
CID 143834335
3-methyl-N-(pyridin-3-ylmethyl)pyrrolidin-3-amine
CID 107424178
7-(difluoromethoxy)-1-(2-piperidin-1-ylethyl)-1,5-naphthyridin-2-one
CID 174589359
1-benzyl-4-(pyridin-3-ylmethylamino)piperidine-4-carboxylic acid
CID 71564992
6-[2-[[(3R,4S)-1-[2-(7-fluoro-2-oxo-1,5-naphthyridin-1-yl)ethyl]-3-hydroxypiperidin-4-yl]amino]ethyl]-4H-pyrido[3,2-b][1,4]oxazin-3-one
CID 143612708
1-[2-[4-[(4-ethylphenyl)methylamino]piperidin-1-yl]ethyl]-7-methoxyquinoxalin-2-one
CID 59398079
N-(2-morpholin-4-ylethyl)-5-(pyridin-3-ylmethylamino)pyrazine-2-carboxamide
CID 109277480
3-[(4,4-difluoropiperidin-1-yl)methyl]pyridine
CID 117007748
2-(2-morpholin-4-ylethylamino)-N-(pyridin-3-ylmethyl)pyridine-4-carboxamide
CID 109168044

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-1-[2-[4-methyl-4-(pyridin-3-ylmethylamino)piperidin-1-yl]ethyl]-1,5-naphthyridin-2-one?
The IUPAC name of 7-fluoro-1-[2-[4-methyl-4-(pyridin-3-ylmethylamino)piperidin-1-yl]ethyl]-1,5-naphthyridin-2-one (CID 69281843) is 7-fluoro-1-[2-[4-methyl-4-(pyridin-3-ylmethylamino)piperidin-1-yl]ethyl]-1,5-naphthyridin-2-one.
What is the SMILES notation for 7-fluoro-1-[2-[4-methyl-4-(pyridin-3-ylmethylamino)piperidin-1-yl]ethyl]-1,5-naphthyridin-2-one?
The canonical SMILES for 7-fluoro-1-[2-[4-methyl-4-(pyridin-3-ylmethylamino)piperidin-1-yl]ethyl]-1,5-naphthyridin-2-one is CC1(NCc2cccnc2)CCN(CCn2c(=O)ccc3ncc(F)cc32)CC1.
What is the InChIKey of 7-fluoro-1-[2-[4-methyl-4-(pyridin-3-ylmethylamino)piperidin-1-yl]ethyl]-1,5-naphthyridin-2-one?
The InChIKey is AUIDBSSLPIUTEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26FN5O/c1-22(26-15-17-3-2-8-24-14-17)6-9-27(10-7-22)11-12-28-20-13-18(23)16-25-19(20)4-5-21(28)29/h2-5,8,13-14,16,26H,6-7,9-12,15H2,1H3.
What are the key properties of 7-fluoro-1-[2-[4-methyl-4-(pyridin-3-ylmethylamino)piperidin-1-yl]ethyl]-1,5-naphthyridin-2-one?
7-fluoro-1-[2-[4-methyl-4-(pyridin-3-ylmethylamino)piperidin-1-yl]ethyl]-1,5-naphthyridin-2-one has a molecular weight of 395.48 g/mol, XLogP of 2.57, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-1-[2-[4-methyl-4-(pyridin-3-ylmethylamino)piperidin-1-yl]ethyl]-1,5-naphthyridin-2-one is sourced from PubChem (CID 69281843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).