3-[4-[(7-fluoro-2,3-dihydro-1H-inden-4-yl)oxy]piperidin-1-yl]-N-methyl-N-pyridin-3-ylpropanamide

C23H28FN3O2 — CID 139712203

IUPAC3-[4-[(7-fluoro-2,3-dihydro-1H-inden-4-yl)oxy]piperidin-1-yl]-N-methyl-N-pyridin-3-ylpropanamide
SMILESCN(C(=O)CCN1CCC(Oc2ccc(F)c3c2CCC3)CC1)c1cccnc1
InChIInChI=1S/C23H28FN3O2/c1-26(17-4-3-12-25-16-17)23(28)11-15-27-13-9-18(10-14-27)29-22-8-7-21(24)19-5-2-6-20(19)22/h3-4,7-8,12,16,18H,2,5-6,9-11,13-15H2,1H3
InChIKeyOLRPAHMSNCPQNA-UHFFFAOYSA-N
MW397.49 g/mol
LogP3.61
Rot. Bonds6

About 3-[4-[(7-fluoro-2,3-dihydro-1H-inden-4-yl)oxy]piperidin-1-yl]-N-methyl-N-pyridin-3-ylpropanamide

3-[4-[(7-fluoro-2,3-dihydro-1H-inden-4-yl)oxy]piperidin-1-yl]-N-methyl-N-pyridin-3-ylpropanamide (PubChem CID 139712203) has the molecular formula C23H28FN3O2 and a molecular weight of 397.49 g/mol. Its IUPAC name is 3-[4-[(7-fluoro-2,3-dihydro-1H-inden-4-yl)oxy]piperidin-1-yl]-N-methyl-N-pyridin-3-ylpropanamide.

Molecular Properties

Compound Name3-[4-[(7-fluoro-2,3-dihydro-1H-inden-4-yl)oxy]piperidin-1-yl]-N-methyl-N-pyridin-3-ylpropanamide
PubChem CID139712203
Molecular FormulaC23H28FN3O2
Molecular Weight397.49 g/mol
Exact Mass397.22
IUPAC Name3-[4-[(7-fluoro-2,3-dihydro-1H-inden-4-yl)oxy]piperidin-1-yl]-N-methyl-N-pyridin-3-ylpropanamide
SMILESCN(C(=O)CCN1CCC(Oc2ccc(F)c3c2CCC3)CC1)c1cccnc1
InChIInChI=1S/C23H28FN3O2/c1-26(17-4-3-12-25-16-17)23(28)11-15-27-13-9-18(10-14-27)29-22-8-7-21(24)19-5-2-6-20(19)22/h3-4,7-8,12,16,18H,2,5-6,9-11,13-15H2,1H3
InChIKeyOLRPAHMSNCPQNA-UHFFFAOYSA-N
XLogP3.61
TPSA45.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.49
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 3-[4-[(7-fluoro-2,3-dihydro-1H-inden-4-yl)oxy]piperidin-1-yl]-N-methyl-N-pyridin-3-ylpropanamide with MolForge

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Related Compounds

4-[(7-fluoro-2,3-dihydro-1H-inden-4-yl)oxy]-N,N-dimethylcyclohexan-1-amine
CID 139677462
8-[2-[4-[(7-fluoro-2,3-dihydro-1H-inden-4-yl)oxy]piperidin-1-yl]ethyl]-7H-purine
CID 139712164
N-methyl-4-piperazin-1-yl-N-pyridin-3-ylbutanamide
CID 115178480
N-methyl-3-(4-methylpiperidin-1-yl)-N-phenylpropanamide
CID 109014553
N-methyl-N-phenyl-3-piperidin-1-ylpropanamide
CID 110688340
N-methyl-3-(4-methylpiperazin-1-yl)-N-phenylpropanamide
CID 110856844
N-(5-amino-2-fluorophenyl)-3-(3-pyridin-3-yloxypyrrolidin-1-yl)propanamide
CID 126807162
[4-[methyl(pyridin-3-yl)carbamoyl]oxycyclohexyl]methyl pyrrolidine-1-carboxylate
CID 66837807
3-[[4-(2-methylphenoxy)piperidin-1-yl]methyl]pyridine
CID 56892936
5-amino-N-methyl-N-pyridin-3-ylhexanamide
CID 82852147
1-[4-(2-methoxyphenoxy)piperidin-1-yl]-2-[methyl(pyridin-3-ylmethyl)amino]ethanone
CID 70782961
(2,3-difluoro-6-methoxyphenyl)-[4-(pyridin-3-ylmethoxy)piperidin-1-yl]methanone
CID 70748748

Frequently Asked Questions

What is the IUPAC name of 3-[4-[(7-fluoro-2,3-dihydro-1H-inden-4-yl)oxy]piperidin-1-yl]-N-methyl-N-pyridin-3-ylpropanamide?
The IUPAC name of 3-[4-[(7-fluoro-2,3-dihydro-1H-inden-4-yl)oxy]piperidin-1-yl]-N-methyl-N-pyridin-3-ylpropanamide (CID 139712203) is 3-[4-[(7-fluoro-2,3-dihydro-1H-inden-4-yl)oxy]piperidin-1-yl]-N-methyl-N-pyridin-3-ylpropanamide.
What is the SMILES notation for 3-[4-[(7-fluoro-2,3-dihydro-1H-inden-4-yl)oxy]piperidin-1-yl]-N-methyl-N-pyridin-3-ylpropanamide?
The canonical SMILES for 3-[4-[(7-fluoro-2,3-dihydro-1H-inden-4-yl)oxy]piperidin-1-yl]-N-methyl-N-pyridin-3-ylpropanamide is CN(C(=O)CCN1CCC(Oc2ccc(F)c3c2CCC3)CC1)c1cccnc1.
What is the InChIKey of 3-[4-[(7-fluoro-2,3-dihydro-1H-inden-4-yl)oxy]piperidin-1-yl]-N-methyl-N-pyridin-3-ylpropanamide?
The InChIKey is OLRPAHMSNCPQNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28FN3O2/c1-26(17-4-3-12-25-16-17)23(28)11-15-27-13-9-18(10-14-27)29-22-8-7-21(24)19-5-2-6-20(19)22/h3-4,7-8,12,16,18H,2,5-6,9-11,13-15H2,1H3.
What are the key properties of 3-[4-[(7-fluoro-2,3-dihydro-1H-inden-4-yl)oxy]piperidin-1-yl]-N-methyl-N-pyridin-3-ylpropanamide?
3-[4-[(7-fluoro-2,3-dihydro-1H-inden-4-yl)oxy]piperidin-1-yl]-N-methyl-N-pyridin-3-ylpropanamide has a molecular weight of 397.49 g/mol, XLogP of 3.61, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-[(7-fluoro-2,3-dihydro-1H-inden-4-yl)oxy]piperidin-1-yl]-N-methyl-N-pyridin-3-ylpropanamide is sourced from PubChem (CID 139712203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).