N-[[1-(3-cyano-7,8-dihydro-5H-pyrano[4,3-b]pyridin-2-yl)-4-fluoropiperidin-4-yl]methyl]cyclopropanecarboxamide

C19H23FN4O2 — CID 175648199

IUPACN-[[1-(3-cyano-7,8-dihydro-5H-pyrano[4,3-b]pyridin-2-yl)-4-fluoropiperidin-4-yl]methyl]cyclopropanecarboxamide
SMILESN#Cc1cc2c(nc1N1CCC(F)(CNC(=O)C3CC3)CC1)CCOC2
InChIInChI=1S/C19H23FN4O2/c20-19(12-22-18(25)13-1-2-13)4-6-24(7-5-19)17-14(10-21)9-15-11-26-8-3-16(15)23-17/h9,13H,1-8,11-12H2,(H,22,25)
InChIKeyISVMVBBPJBYDNI-UHFFFAOYSA-N
MW358.42 g/mol
LogP1.86
Rot. Bonds4

About N-[[1-(3-cyano-7,8-dihydro-5H-pyrano[4,3-b]pyridin-2-yl)-4-fluoropiperidin-4-yl]methyl]cyclopropanecarboxamide

N-[[1-(3-cyano-7,8-dihydro-5H-pyrano[4,3-b]pyridin-2-yl)-4-fluoropiperidin-4-yl]methyl]cyclopropanecarboxamide (PubChem CID 175648199) has the molecular formula C19H23FN4O2 and a molecular weight of 358.42 g/mol. Its IUPAC name is N-[[1-(3-cyano-7,8-dihydro-5H-pyrano[4,3-b]pyridin-2-yl)-4-fluoropiperidin-4-yl]methyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[[1-(3-cyano-7,8-dihydro-5H-pyrano[4,3-b]pyridin-2-yl)-4-fluoropiperidin-4-yl]methyl]cyclopropanecarboxamide
PubChem CID175648199
Molecular FormulaC19H23FN4O2
Molecular Weight358.42 g/mol
Exact Mass358.18
IUPAC NameN-[[1-(3-cyano-7,8-dihydro-5H-pyrano[4,3-b]pyridin-2-yl)-4-fluoropiperidin-4-yl]methyl]cyclopropanecarboxamide
SMILESN#Cc1cc2c(nc1N1CCC(F)(CNC(=O)C3CC3)CC1)CCOC2
InChIInChI=1S/C19H23FN4O2/c20-19(12-22-18(25)13-1-2-13)4-6-24(7-5-19)17-14(10-21)9-15-11-26-8-3-16(15)23-17/h9,13H,1-8,11-12H2,(H,22,25)
InChIKeyISVMVBBPJBYDNI-UHFFFAOYSA-N
XLogP1.86
TPSA78.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.42
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[[1-(3-cyano-7,8-dihydro-5H-pyrano[4,3-b]pyridin-2-yl)-4-fluoropiperidin-4-yl]methyl]cyclopropanecarboxamide with MolForge

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Launch Full Analysis

Related Compounds

2-(4,4-difluoropiperidin-1-yl)-7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-carbonitrile
CID 138988925
2-[4-(pyrimidin-4-ylamino)piperidin-1-yl]-7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-carbonitrile
CID 126887406
2-[4-(4-oxoquinazolin-3-yl)piperidin-1-yl]-7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-carbonitrile
CID 166260630
2-[3-(4-propan-2-ylpiperazin-1-yl)azetidin-1-yl]-7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-carbonitrile
CID 126892414
2-[3-[4-(3-methyl-2-oxoimidazolidin-1-yl)pyrazol-1-yl]azetidin-1-yl]-7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-carbonitrile
CID 126946237
2-(5-hydroxy-1-oxa-9-azaspiro[5.5]undecan-9-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
CID 72842994
N-[[4-fluoro-1-(9-methylpurin-6-yl)piperidin-4-yl]methyl]oxolane-3-carboxamide
CID 166601069
2-[4-(pyrrolidine-1-carbonyl)piperidin-1-yl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile
CID 70727057
N-[[1-(5-bromopyrimidin-2-yl)-4-fluoropiperidin-4-yl]methyl]oxolane-3-carboxamide
CID 165432283
2-[4-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]piperazin-1-yl]-7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-carbonitrile
CID 155801038
2-[1-(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)piperidin-4-yl]-N-(2,2-difluoroethyl)acetamide
CID 175648562
N-[[4-fluoro-1-(4-methoxypyrimidin-2-yl)piperidin-4-yl]methyl]cyclopropanecarboxamide
CID 165432135

Frequently Asked Questions

What is the IUPAC name of N-[[1-(3-cyano-7,8-dihydro-5H-pyrano[4,3-b]pyridin-2-yl)-4-fluoropiperidin-4-yl]methyl]cyclopropanecarboxamide?
The IUPAC name of N-[[1-(3-cyano-7,8-dihydro-5H-pyrano[4,3-b]pyridin-2-yl)-4-fluoropiperidin-4-yl]methyl]cyclopropanecarboxamide (CID 175648199) is N-[[1-(3-cyano-7,8-dihydro-5H-pyrano[4,3-b]pyridin-2-yl)-4-fluoropiperidin-4-yl]methyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[[1-(3-cyano-7,8-dihydro-5H-pyrano[4,3-b]pyridin-2-yl)-4-fluoropiperidin-4-yl]methyl]cyclopropanecarboxamide?
The canonical SMILES for N-[[1-(3-cyano-7,8-dihydro-5H-pyrano[4,3-b]pyridin-2-yl)-4-fluoropiperidin-4-yl]methyl]cyclopropanecarboxamide is N#Cc1cc2c(nc1N1CCC(F)(CNC(=O)C3CC3)CC1)CCOC2.
What is the InChIKey of N-[[1-(3-cyano-7,8-dihydro-5H-pyrano[4,3-b]pyridin-2-yl)-4-fluoropiperidin-4-yl]methyl]cyclopropanecarboxamide?
The InChIKey is ISVMVBBPJBYDNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN4O2/c20-19(12-22-18(25)13-1-2-13)4-6-24(7-5-19)17-14(10-21)9-15-11-26-8-3-16(15)23-17/h9,13H,1-8,11-12H2,(H,22,25).
What are the key properties of N-[[1-(3-cyano-7,8-dihydro-5H-pyrano[4,3-b]pyridin-2-yl)-4-fluoropiperidin-4-yl]methyl]cyclopropanecarboxamide?
N-[[1-(3-cyano-7,8-dihydro-5H-pyrano[4,3-b]pyridin-2-yl)-4-fluoropiperidin-4-yl]methyl]cyclopropanecarboxamide has a molecular weight of 358.42 g/mol, XLogP of 1.86, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(3-cyano-7,8-dihydro-5H-pyrano[4,3-b]pyridin-2-yl)-4-fluoropiperidin-4-yl]methyl]cyclopropanecarboxamide is sourced from PubChem (CID 175648199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).