N-methyl-1'-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine

C17H26N2O — CID 114711983

IUPACN-methyl-1'-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine
SMILESCCCN1CCC2(CC1)CC(NC)c1ccccc1O2
InChIInChI=1S/C17H26N2O/c1-3-10-19-11-8-17(9-12-19)13-15(18-2)14-6-4-5-7-16(14)20-17/h4-7,15,18H,3,8-13H2,1-2H3
InChIKeyQZYWYKIKUQAASQ-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.97
Rot. Bonds3

About N-methyl-1'-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine

N-methyl-1'-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine (PubChem CID 114711983) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is N-methyl-1'-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine.

Molecular Properties

Compound NameN-methyl-1'-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine
PubChem CID114711983
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC NameN-methyl-1'-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine
SMILESCCCN1CCC2(CC1)CC(NC)c1ccccc1O2
InChIInChI=1S/C17H26N2O/c1-3-10-19-11-8-17(9-12-19)13-15(18-2)14-6-4-5-7-16(14)20-17/h4-7,15,18H,3,8-13H2,1-2H3
InChIKeyQZYWYKIKUQAASQ-UHFFFAOYSA-N
XLogP2.97
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1'-propylspiro[3,4-dihydrochromene-2,4'-azepane]-4-ol
CID 114714975
N-ethyl-1'-methylspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-amine
CID 114712287
N-(1'-ethylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-yl)cyclopropanesulfonamide
CID 131638561
N,3',5'-trimethylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-amine
CID 114711957
N-methyl-4'-propan-2-ylspiro[3,4-dihydrochromene-2,1'-cycloheptane]-4-amine
CID 114712137
1'-ethyl-N-(pyridin-2-ylmethyl)spiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine
CID 134075744
(4R)-6-chloro-1'-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol
CID 104949110
2-ethyl-N,2-dimethyl-3,4-dihydrochromen-4-amine
CID 82462113
1'-ethylspiro[3,4-dihydrochromene-2,4'-azepane]-4-amine
CID 114709485
(4R)-1'-ethylspiro[3,4-dihydrochromene-2,4'-azepane]-4-amine
CID 104946207
1-[4-[2-[[(4R)-spiro[3,4-dihydrochromene-2,1'-cyclobutane]-4-yl]amino]ethyl]piperazin-1-yl]ethanone
CID 97098382
3'-methoxy-N-methylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-amine
CID 106875170

Frequently Asked Questions

What is the IUPAC name of N-methyl-1'-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine?
The IUPAC name of N-methyl-1'-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine (CID 114711983) is N-methyl-1'-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine.
What is the SMILES notation for N-methyl-1'-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine?
The canonical SMILES for N-methyl-1'-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine is CCCN1CCC2(CC1)CC(NC)c1ccccc1O2.
What is the InChIKey of N-methyl-1'-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine?
The InChIKey is QZYWYKIKUQAASQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-3-10-19-11-8-17(9-12-19)13-15(18-2)14-6-4-5-7-16(14)20-17/h4-7,15,18H,3,8-13H2,1-2H3.
What are the key properties of N-methyl-1'-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine?
N-methyl-1'-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine has a molecular weight of 274.41 g/mol, XLogP of 2.97, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1'-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine is sourced from PubChem (CID 114711983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).