[6-(1-propan-2-ylpiperidin-4-yl)oxynaphthalen-1-yl]-pyrrolidin-1-ylmethanone

C23H30N2O2 — CID 44578678

IUPAC[6-(1-propan-2-ylpiperidin-4-yl)oxynaphthalen-1-yl]-pyrrolidin-1-ylmethanone
SMILESCC(C)N1CCC(Oc2ccc3c(C(=O)N4CCCC4)cccc3c2)CC1
InChIInChI=1S/C23H30N2O2/c1-17(2)24-14-10-19(11-15-24)27-20-8-9-21-18(16-20)6-5-7-22(21)23(26)25-12-3-4-13-25/h5-9,16-17,19H,3-4,10-15H2,1-2H3
InChIKeyDCIFTBTYUMRCRJ-UHFFFAOYSA-N
MW366.50 g/mol
LogP4.33
Rot. Bonds4

About [6-(1-propan-2-ylpiperidin-4-yl)oxynaphthalen-1-yl]-pyrrolidin-1-ylmethanone

[6-(1-propan-2-ylpiperidin-4-yl)oxynaphthalen-1-yl]-pyrrolidin-1-ylmethanone (PubChem CID 44578678) has the molecular formula C23H30N2O2 and a molecular weight of 366.50 g/mol. Its IUPAC name is [6-(1-propan-2-ylpiperidin-4-yl)oxynaphthalen-1-yl]-pyrrolidin-1-ylmethanone.

Molecular Properties

Compound Name[6-(1-propan-2-ylpiperidin-4-yl)oxynaphthalen-1-yl]-pyrrolidin-1-ylmethanone
PubChem CID44578678
Molecular FormulaC23H30N2O2
Molecular Weight366.50 g/mol
Exact Mass366.23
IUPAC Name[6-(1-propan-2-ylpiperidin-4-yl)oxynaphthalen-1-yl]-pyrrolidin-1-ylmethanone
SMILESCC(C)N1CCC(Oc2ccc3c(C(=O)N4CCCC4)cccc3c2)CC1
InChIInChI=1S/C23H30N2O2/c1-17(2)24-14-10-19(11-15-24)27-20-8-9-21-18(16-20)6-5-7-22(21)23(26)25-12-3-4-13-25/h5-9,16-17,19H,3-4,10-15H2,1-2H3
InChIKeyDCIFTBTYUMRCRJ-UHFFFAOYSA-N
XLogP4.33
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.50
LogP ≤ 54.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[6-(1-propan-2-ylpiperidin-4-yl)oxyquinolin-2-yl]-pyrrolidin-1-ylmethanone
CID 11617590
(4-propan-2-ylpiperazin-1-yl)-[6-(1-propan-2-ylpiperidin-4-yl)oxynaphthalen-2-yl]methanone
CID 69070920
(4-cyclopentylpiperazin-1-yl)-[6-(1-propan-2-ylpiperidin-4-yl)oxynaphthalen-2-yl]methanone
CID 69067801
(4-propan-2-ylpiperazin-1-yl)-[5-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indol-2-yl]methanone
CID 69284738
5-(1-propan-2-ylpiperidin-4-yl)oxy-1-benzothiophene-2-carboxylic acid
CID 68728287
1-[5-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indole-2-carbonyl]piperidine-4-carboxamide
CID 69283945
azepan-1-yl-[6-(1-propan-2-ylpyrrolidin-3-yl)oxy-1H-indol-2-yl]methanone
CID 69282604
(4-methoxypiperidin-1-yl)-[6-(1-propan-2-ylpiperidin-4-yl)oxyquinolin-2-yl]methanone
CID 11654491
1-(naphthalene-1-carbonyl)-N-(1-propan-2-ylpiperidin-4-yl)piperidine-3-carboxamide
CID 24542998
[6-(1-propan-2-ylpiperidin-4-yl)oxyquinolin-2-yl]-thiomorpholin-4-ylmethanone
CID 11718271
(4,4-difluoropiperidin-1-yl)-[1-(3-methoxyphenyl)-5-(1-propan-2-ylpiperidin-4-yl)oxyindol-2-yl]methanone
CID 16739480
methyl 4-[1-propan-2-yl-5-(1-propan-2-ylpiperidin-4-yl)oxyindole-2-carbonyl]piperazine-1-carboxylate
CID 24959291

Frequently Asked Questions

What is the IUPAC name of [6-(1-propan-2-ylpiperidin-4-yl)oxynaphthalen-1-yl]-pyrrolidin-1-ylmethanone?
The IUPAC name of [6-(1-propan-2-ylpiperidin-4-yl)oxynaphthalen-1-yl]-pyrrolidin-1-ylmethanone (CID 44578678) is [6-(1-propan-2-ylpiperidin-4-yl)oxynaphthalen-1-yl]-pyrrolidin-1-ylmethanone.
What is the SMILES notation for [6-(1-propan-2-ylpiperidin-4-yl)oxynaphthalen-1-yl]-pyrrolidin-1-ylmethanone?
The canonical SMILES for [6-(1-propan-2-ylpiperidin-4-yl)oxynaphthalen-1-yl]-pyrrolidin-1-ylmethanone is CC(C)N1CCC(Oc2ccc3c(C(=O)N4CCCC4)cccc3c2)CC1.
What is the InChIKey of [6-(1-propan-2-ylpiperidin-4-yl)oxynaphthalen-1-yl]-pyrrolidin-1-ylmethanone?
The InChIKey is DCIFTBTYUMRCRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O2/c1-17(2)24-14-10-19(11-15-24)27-20-8-9-21-18(16-20)6-5-7-22(21)23(26)25-12-3-4-13-25/h5-9,16-17,19H,3-4,10-15H2,1-2H3.
What are the key properties of [6-(1-propan-2-ylpiperidin-4-yl)oxynaphthalen-1-yl]-pyrrolidin-1-ylmethanone?
[6-(1-propan-2-ylpiperidin-4-yl)oxynaphthalen-1-yl]-pyrrolidin-1-ylmethanone has a molecular weight of 366.50 g/mol, XLogP of 4.33, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(1-propan-2-ylpiperidin-4-yl)oxynaphthalen-1-yl]-pyrrolidin-1-ylmethanone is sourced from PubChem (CID 44578678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).