7-methylspiro[2,4-dihydronaphthalene-3,4'-piperidine]-1-one

C15H19NO — CID 170134760

IUPAC7-methylspiro[2,4-dihydronaphthalene-3,4'-piperidine]-1-one
SMILESCc1ccc2c(c1)C(=O)CC1(CCNCC1)C2
InChIInChI=1S/C15H19NO/c1-11-2-3-12-9-15(4-6-16-7-5-15)10-14(17)13(12)8-11/h2-3,8,16H,4-7,9-10H2,1H3
InChIKeyKVURNIAXBLYSOR-UHFFFAOYSA-N
MW229.32 g/mol
LogP2.49
Rot. Bonds

About 7-methylspiro[2,4-dihydronaphthalene-3,4'-piperidine]-1-one

7-methylspiro[2,4-dihydronaphthalene-3,4'-piperidine]-1-one (PubChem CID 170134760) has the molecular formula C15H19NO and a molecular weight of 229.32 g/mol. Its IUPAC name is 7-methylspiro[2,4-dihydronaphthalene-3,4'-piperidine]-1-one.

Molecular Properties

Compound Name7-methylspiro[2,4-dihydronaphthalene-3,4'-piperidine]-1-one
PubChem CID170134760
Molecular FormulaC15H19NO
Molecular Weight229.32 g/mol
Exact Mass229.15
IUPAC Name7-methylspiro[2,4-dihydronaphthalene-3,4'-piperidine]-1-one
SMILESCc1ccc2c(c1)C(=O)CC1(CCNCC1)C2
InChIInChI=1S/C15H19NO/c1-11-2-3-12-9-15(4-6-16-7-5-15)10-14(17)13(12)8-11/h2-3,8,16H,4-7,9-10H2,1H3
InChIKeyKVURNIAXBLYSOR-UHFFFAOYSA-N
XLogP2.49
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-methylspiro[2,4-dihydronaphthalene-3,4'-piperidine]-1-one?
The IUPAC name of 7-methylspiro[2,4-dihydronaphthalene-3,4'-piperidine]-1-one (CID 170134760) is 7-methylspiro[2,4-dihydronaphthalene-3,4'-piperidine]-1-one.
What is the SMILES notation for 7-methylspiro[2,4-dihydronaphthalene-3,4'-piperidine]-1-one?
The canonical SMILES for 7-methylspiro[2,4-dihydronaphthalene-3,4'-piperidine]-1-one is Cc1ccc2c(c1)C(=O)CC1(CCNCC1)C2.
What is the InChIKey of 7-methylspiro[2,4-dihydronaphthalene-3,4'-piperidine]-1-one?
The InChIKey is KVURNIAXBLYSOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO/c1-11-2-3-12-9-15(4-6-16-7-5-15)10-14(17)13(12)8-11/h2-3,8,16H,4-7,9-10H2,1H3.
What are the key properties of 7-methylspiro[2,4-dihydronaphthalene-3,4'-piperidine]-1-one?
7-methylspiro[2,4-dihydronaphthalene-3,4'-piperidine]-1-one has a molecular weight of 229.32 g/mol, XLogP of 2.49, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methylspiro[2,4-dihydronaphthalene-3,4'-piperidine]-1-one is sourced from PubChem (CID 170134760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).