N-ethyl-1'-methylspiro[3,4-dihydrochromene-2,3'-piperidine]-4-amine

C16H24N2O — CID 114712286

IUPACN-ethyl-1'-methylspiro[3,4-dihydrochromene-2,3'-piperidine]-4-amine
SMILESCCNC1CC2(CCCN(C)C2)Oc2ccccc21
InChIInChI=1S/C16H24N2O/c1-3-17-14-11-16(9-6-10-18(2)12-16)19-15-8-5-4-7-13(14)15/h4-5,7-8,14,17H,3,6,9-12H2,1-2H3
InChIKeyIWUBUDSNEXILCI-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.58
Rot. Bonds2

About N-ethyl-1'-methylspiro[3,4-dihydrochromene-2,3'-piperidine]-4-amine

N-ethyl-1'-methylspiro[3,4-dihydrochromene-2,3'-piperidine]-4-amine (PubChem CID 114712286) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is N-ethyl-1'-methylspiro[3,4-dihydrochromene-2,3'-piperidine]-4-amine.

Molecular Properties

Compound NameN-ethyl-1'-methylspiro[3,4-dihydrochromene-2,3'-piperidine]-4-amine
PubChem CID114712286
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC NameN-ethyl-1'-methylspiro[3,4-dihydrochromene-2,3'-piperidine]-4-amine
SMILESCCNC1CC2(CCCN(C)C2)Oc2ccccc21
InChIInChI=1S/C16H24N2O/c1-3-17-14-11-16(9-6-10-18(2)12-16)19-15-8-5-4-7-13(14)15/h4-5,7-8,14,17H,3,6,9-12H2,1-2H3
InChIKeyIWUBUDSNEXILCI-UHFFFAOYSA-N
XLogP2.58
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-1'-methylspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-amine
CID 114712287
7-bromo-N-ethyl-1'-methylspiro[3,4-dihydrochromene-2,3'-piperidine]-4-amine
CID 114711803
1'-cyclopropyl-N-ethylspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-amine
CID 114712252
N-ethyl-4',4'-dimethylspiro[3,4-dihydrochromene-2,1'-cycloheptane]-4-amine
CID 114712158
N-ethyl-7-methoxy-1'-methylspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-amine
CID 114711027
N-ethyl-4'-methylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-amine
CID 114712239
N-ethyl-2'-propylspiro[3,4-dihydrochromene-2,4'-oxane]-4-amine
CID 114712323
(4R)-1'-methylspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-amine
CID 104946242
N-[2-methyl-3-(4-methylpiperazin-1-yl)propyl]spiro[3,4-dihydrochromene-2,1'-cyclobutane]-4-amine
CID 75383131
1-[4-[2-[[(4R)-spiro[3,4-dihydrochromene-2,1'-cyclobutane]-4-yl]amino]ethyl]piperazin-1-yl]ethanone
CID 97098382
7-bromo-N-ethylspiro[3,4-dihydrochromene-2,1'-cyclooctane]-4-amine
CID 114711827
N-methyl-1'-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine
CID 114711983

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1'-methylspiro[3,4-dihydrochromene-2,3'-piperidine]-4-amine?
The IUPAC name of N-ethyl-1'-methylspiro[3,4-dihydrochromene-2,3'-piperidine]-4-amine (CID 114712286) is N-ethyl-1'-methylspiro[3,4-dihydrochromene-2,3'-piperidine]-4-amine.
What is the SMILES notation for N-ethyl-1'-methylspiro[3,4-dihydrochromene-2,3'-piperidine]-4-amine?
The canonical SMILES for N-ethyl-1'-methylspiro[3,4-dihydrochromene-2,3'-piperidine]-4-amine is CCNC1CC2(CCCN(C)C2)Oc2ccccc21.
What is the InChIKey of N-ethyl-1'-methylspiro[3,4-dihydrochromene-2,3'-piperidine]-4-amine?
The InChIKey is IWUBUDSNEXILCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-3-17-14-11-16(9-6-10-18(2)12-16)19-15-8-5-4-7-13(14)15/h4-5,7-8,14,17H,3,6,9-12H2,1-2H3.
What are the key properties of N-ethyl-1'-methylspiro[3,4-dihydrochromene-2,3'-piperidine]-4-amine?
N-ethyl-1'-methylspiro[3,4-dihydrochromene-2,3'-piperidine]-4-amine has a molecular weight of 260.38 g/mol, XLogP of 2.58, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1'-methylspiro[3,4-dihydrochromene-2,3'-piperidine]-4-amine is sourced from PubChem (CID 114712286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).