7-methoxy-N-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine

C17H26N2O2 — CID 114711050

IUPAC7-methoxy-N-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine
SMILESCCCNC1CC2(CCNCC2)Oc2cc(OC)ccc21
InChIInChI=1S/C17H26N2O2/c1-3-8-19-15-12-17(6-9-18-10-7-17)21-16-11-13(20-2)4-5-14(15)16/h4-5,11,15,18-19H,3,6-10,12H2,1-2H3
InChIKeyRAHXMTYZWZJCHQ-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.64
Rot. Bonds4

About 7-methoxy-N-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine

7-methoxy-N-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine (PubChem CID 114711050) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 7-methoxy-N-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine.

Molecular Properties

Compound Name7-methoxy-N-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine
PubChem CID114711050
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name7-methoxy-N-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine
SMILESCCCNC1CC2(CCNCC2)Oc2cc(OC)ccc21
InChIInChI=1S/C17H26N2O2/c1-3-8-19-15-12-17(6-9-18-10-7-17)21-16-11-13(20-2)4-5-14(15)16/h4-5,11,15,18-19H,3,6-10,12H2,1-2H3
InChIKeyRAHXMTYZWZJCHQ-UHFFFAOYSA-N
XLogP2.64
TPSA42.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-N-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine?
The IUPAC name of 7-methoxy-N-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine (CID 114711050) is 7-methoxy-N-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine.
What is the SMILES notation for 7-methoxy-N-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine?
The canonical SMILES for 7-methoxy-N-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine is CCCNC1CC2(CCNCC2)Oc2cc(OC)ccc21.
What is the InChIKey of 7-methoxy-N-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine?
The InChIKey is RAHXMTYZWZJCHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-3-8-19-15-12-17(6-9-18-10-7-17)21-16-11-13(20-2)4-5-14(15)16/h4-5,11,15,18-19H,3,6-10,12H2,1-2H3.
What are the key properties of 7-methoxy-N-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine?
7-methoxy-N-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine has a molecular weight of 290.41 g/mol, XLogP of 2.64, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-N-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine is sourced from PubChem (CID 114711050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).