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

C18H28N2 — CID 63156873

IUPAC[2-(4-ethyl-4-methylpiperidin-1-yl)-1,3-dihydroinden-2-yl]methanamine
SMILESCCC1(C)CCN(C2(CN)Cc3ccccc3C2)CC1
InChIInChI=1S/C18H28N2/c1-3-17(2)8-10-20(11-9-17)18(14-19)12-15-6-4-5-7-16(15)13-18/h4-7H,3,8-14,19H2,1-2H3
InChIKeyAZVUXTRTTQLGKN-UHFFFAOYSA-N
MW272.44 g/mol
LogP2.99
Rot. Bonds3

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

[2-(4-ethyl-4-methylpiperidin-1-yl)-1,3-dihydroinden-2-yl]methanamine (PubChem CID 63156873) has the molecular formula C18H28N2 and a molecular weight of 272.44 g/mol. Its IUPAC name is [2-(4-ethyl-4-methylpiperidin-1-yl)-1,3-dihydroinden-2-yl]methanamine.

Molecular Properties

Compound Name[2-(4-ethyl-4-methylpiperidin-1-yl)-1,3-dihydroinden-2-yl]methanamine
PubChem CID63156873
Molecular FormulaC18H28N2
Molecular Weight272.44 g/mol
Exact Mass272.23
IUPAC Name[2-(4-ethyl-4-methylpiperidin-1-yl)-1,3-dihydroinden-2-yl]methanamine
SMILESCCC1(C)CCN(C2(CN)Cc3ccccc3C2)CC1
InChIInChI=1S/C18H28N2/c1-3-17(2)8-10-20(11-9-17)18(14-19)12-15-6-4-5-7-16(15)13-18/h4-7H,3,8-14,19H2,1-2H3
InChIKeyAZVUXTRTTQLGKN-UHFFFAOYSA-N
XLogP2.99
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.44
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [2-(4-ethyl-4-methylpiperidin-1-yl)-1,3-dihydroinden-2-yl]methanamine?
The IUPAC name of [2-(4-ethyl-4-methylpiperidin-1-yl)-1,3-dihydroinden-2-yl]methanamine (CID 63156873) is [2-(4-ethyl-4-methylpiperidin-1-yl)-1,3-dihydroinden-2-yl]methanamine.
What is the SMILES notation for [2-(4-ethyl-4-methylpiperidin-1-yl)-1,3-dihydroinden-2-yl]methanamine?
The canonical SMILES for [2-(4-ethyl-4-methylpiperidin-1-yl)-1,3-dihydroinden-2-yl]methanamine is CCC1(C)CCN(C2(CN)Cc3ccccc3C2)CC1.
What is the InChIKey of [2-(4-ethyl-4-methylpiperidin-1-yl)-1,3-dihydroinden-2-yl]methanamine?
The InChIKey is AZVUXTRTTQLGKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2/c1-3-17(2)8-10-20(11-9-17)18(14-19)12-15-6-4-5-7-16(15)13-18/h4-7H,3,8-14,19H2,1-2H3.
What are the key properties of [2-(4-ethyl-4-methylpiperidin-1-yl)-1,3-dihydroinden-2-yl]methanamine?
[2-(4-ethyl-4-methylpiperidin-1-yl)-1,3-dihydroinden-2-yl]methanamine has a molecular weight of 272.44 g/mol, XLogP of 2.99, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-ethyl-4-methylpiperidin-1-yl)-1,3-dihydroinden-2-yl]methanamine is sourced from PubChem (CID 63156873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).