[2-(3-ethylmorpholin-4-yl)-1,3-dihydroinden-2-yl]methanamine

C16H24N2O — CID 43809109

IUPAC[2-(3-ethylmorpholin-4-yl)-1,3-dihydroinden-2-yl]methanamine
SMILESCCC1COCCN1C1(CN)Cc2ccccc2C1
InChIInChI=1S/C16H24N2O/c1-2-15-11-19-8-7-18(15)16(12-17)9-13-5-3-4-6-14(13)10-16/h3-6,15H,2,7-12,17H2,1H3
InChIKeyKYRMIKYHVJIYMQ-UHFFFAOYSA-N
MW260.38 g/mol
LogP1.59
Rot. Bonds3

About [2-(3-ethylmorpholin-4-yl)-1,3-dihydroinden-2-yl]methanamine

[2-(3-ethylmorpholin-4-yl)-1,3-dihydroinden-2-yl]methanamine (PubChem CID 43809109) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is [2-(3-ethylmorpholin-4-yl)-1,3-dihydroinden-2-yl]methanamine.

Molecular Properties

Compound Name[2-(3-ethylmorpholin-4-yl)-1,3-dihydroinden-2-yl]methanamine
PubChem CID43809109
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name[2-(3-ethylmorpholin-4-yl)-1,3-dihydroinden-2-yl]methanamine
SMILESCCC1COCCN1C1(CN)Cc2ccccc2C1
InChIInChI=1S/C16H24N2O/c1-2-15-11-19-8-7-18(15)16(12-17)9-13-5-3-4-6-14(13)10-16/h3-6,15H,2,7-12,17H2,1H3
InChIKeyKYRMIKYHVJIYMQ-UHFFFAOYSA-N
XLogP1.59
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-(3-ethylmorpholin-4-yl)-1,3-dihydroinden-2-yl]methanamine?
The IUPAC name of [2-(3-ethylmorpholin-4-yl)-1,3-dihydroinden-2-yl]methanamine (CID 43809109) is [2-(3-ethylmorpholin-4-yl)-1,3-dihydroinden-2-yl]methanamine.
What is the SMILES notation for [2-(3-ethylmorpholin-4-yl)-1,3-dihydroinden-2-yl]methanamine?
The canonical SMILES for [2-(3-ethylmorpholin-4-yl)-1,3-dihydroinden-2-yl]methanamine is CCC1COCCN1C1(CN)Cc2ccccc2C1.
What is the InChIKey of [2-(3-ethylmorpholin-4-yl)-1,3-dihydroinden-2-yl]methanamine?
The InChIKey is KYRMIKYHVJIYMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-2-15-11-19-8-7-18(15)16(12-17)9-13-5-3-4-6-14(13)10-16/h3-6,15H,2,7-12,17H2,1H3.
What are the key properties of [2-(3-ethylmorpholin-4-yl)-1,3-dihydroinden-2-yl]methanamine?
[2-(3-ethylmorpholin-4-yl)-1,3-dihydroinden-2-yl]methanamine has a molecular weight of 260.38 g/mol, XLogP of 1.59, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-ethylmorpholin-4-yl)-1,3-dihydroinden-2-yl]methanamine is sourced from PubChem (CID 43809109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).