7,8-dimethoxy-N,N-dimethylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine

C17H26N2O3 — CID 82046930

IUPAC7,8-dimethoxy-N,N-dimethylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine
SMILESCOc1ccc2c(c1OC)OC1(CCNCC1)CC2N(C)C
InChIInChI=1S/C17H26N2O3/c1-19(2)13-11-17(7-9-18-10-8-17)22-15-12(13)5-6-14(20-3)16(15)21-4/h5-6,13,18H,7-11H2,1-4H3
InChIKeyHZNAXRKOBFUNDO-UHFFFAOYSA-N
MW306.41 g/mol
LogP2.21
Rot. Bonds3

About 7,8-dimethoxy-N,N-dimethylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine

7,8-dimethoxy-N,N-dimethylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine (PubChem CID 82046930) has the molecular formula C17H26N2O3 and a molecular weight of 306.41 g/mol. Its IUPAC name is 7,8-dimethoxy-N,N-dimethylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine.

Molecular Properties

Compound Name7,8-dimethoxy-N,N-dimethylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine
PubChem CID82046930
Molecular FormulaC17H26N2O3
Molecular Weight306.41 g/mol
Exact Mass306.19
IUPAC Name7,8-dimethoxy-N,N-dimethylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine
SMILESCOc1ccc2c(c1OC)OC1(CCNCC1)CC2N(C)C
InChIInChI=1S/C17H26N2O3/c1-19(2)13-11-17(7-9-18-10-8-17)22-15-12(13)5-6-14(20-3)16(15)21-4/h5-6,13,18H,7-11H2,1-4H3
InChIKeyHZNAXRKOBFUNDO-UHFFFAOYSA-N
XLogP2.21
TPSA42.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7,8-dimethoxy-N,N-dimethylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine?
The IUPAC name of 7,8-dimethoxy-N,N-dimethylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine (CID 82046930) is 7,8-dimethoxy-N,N-dimethylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine.
What is the SMILES notation for 7,8-dimethoxy-N,N-dimethylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine?
The canonical SMILES for 7,8-dimethoxy-N,N-dimethylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine is COc1ccc2c(c1OC)OC1(CCNCC1)CC2N(C)C.
What is the InChIKey of 7,8-dimethoxy-N,N-dimethylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine?
The InChIKey is HZNAXRKOBFUNDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O3/c1-19(2)13-11-17(7-9-18-10-8-17)22-15-12(13)5-6-14(20-3)16(15)21-4/h5-6,13,18H,7-11H2,1-4H3.
What are the key properties of 7,8-dimethoxy-N,N-dimethylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine?
7,8-dimethoxy-N,N-dimethylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine has a molecular weight of 306.41 g/mol, XLogP of 2.21, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7,8-dimethoxy-N,N-dimethylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine is sourced from PubChem (CID 82046930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).