1'-methylspiro[chromene-2,4'-piperidine]-6-amine

C14H18N2O — CID 57416098

IUPAC1'-methylspiro[chromene-2,4'-piperidine]-6-amine
SMILESCN1CCC2(C=Cc3cc(N)ccc3O2)CC1
InChIInChI=1S/C14H18N2O/c1-16-8-6-14(7-9-16)5-4-11-10-12(15)2-3-13(11)17-14/h2-5,10H,6-9,15H2,1H3
InChIKeyMTANZIBYYAKIBU-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.14
Rot. Bonds

About 1'-methylspiro[chromene-2,4'-piperidine]-6-amine

1'-methylspiro[chromene-2,4'-piperidine]-6-amine (PubChem CID 57416098) has the molecular formula C14H18N2O and a molecular weight of 230.31 g/mol. Its IUPAC name is 1'-methylspiro[chromene-2,4'-piperidine]-6-amine.

Molecular Properties

Compound Name1'-methylspiro[chromene-2,4'-piperidine]-6-amine
PubChem CID57416098
Molecular FormulaC14H18N2O
Molecular Weight230.31 g/mol
Exact Mass230.14
IUPAC Name1'-methylspiro[chromene-2,4'-piperidine]-6-amine
SMILESCN1CCC2(C=Cc3cc(N)ccc3O2)CC1
InChIInChI=1S/C14H18N2O/c1-16-8-6-14(7-9-16)5-4-11-10-12(15)2-3-13(11)17-14/h2-5,10H,6-9,15H2,1H3
InChIKeyMTANZIBYYAKIBU-UHFFFAOYSA-N
XLogP2.14
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1'-methylspiro[chromene-2,4'-piperidine]-6-amine?
The IUPAC name of 1'-methylspiro[chromene-2,4'-piperidine]-6-amine (CID 57416098) is 1'-methylspiro[chromene-2,4'-piperidine]-6-amine.
What is the SMILES notation for 1'-methylspiro[chromene-2,4'-piperidine]-6-amine?
The canonical SMILES for 1'-methylspiro[chromene-2,4'-piperidine]-6-amine is CN1CCC2(C=Cc3cc(N)ccc3O2)CC1.
What is the InChIKey of 1'-methylspiro[chromene-2,4'-piperidine]-6-amine?
The InChIKey is MTANZIBYYAKIBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c1-16-8-6-14(7-9-16)5-4-11-10-12(15)2-3-13(11)17-14/h2-5,10H,6-9,15H2,1H3.
What are the key properties of 1'-methylspiro[chromene-2,4'-piperidine]-6-amine?
1'-methylspiro[chromene-2,4'-piperidine]-6-amine has a molecular weight of 230.31 g/mol, XLogP of 2.14, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-methylspiro[chromene-2,4'-piperidine]-6-amine is sourced from PubChem (CID 57416098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).