2-(aminomethyl)-N-(3-methylcyclopentyl)-1,3-dihydroinden-2-amine

C16H24N2 — CID 114544662

IUPAC2-(aminomethyl)-N-(3-methylcyclopentyl)-1,3-dihydroinden-2-amine
SMILESCC1CCC(NC2(CN)Cc3ccccc3C2)C1
InChIInChI=1S/C16H24N2/c1-12-6-7-15(8-12)18-16(11-17)9-13-4-2-3-5-14(13)10-16/h2-5,12,15,18H,6-11,17H2,1H3
InChIKeyOBVWERXJSBBWGI-UHFFFAOYSA-N
MW244.38 g/mol
LogP2.26
Rot. Bonds3

About 2-(aminomethyl)-N-(3-methylcyclopentyl)-1,3-dihydroinden-2-amine

2-(aminomethyl)-N-(3-methylcyclopentyl)-1,3-dihydroinden-2-amine (PubChem CID 114544662) has the molecular formula C16H24N2 and a molecular weight of 244.38 g/mol. Its IUPAC name is 2-(aminomethyl)-N-(3-methylcyclopentyl)-1,3-dihydroinden-2-amine.

Molecular Properties

Compound Name2-(aminomethyl)-N-(3-methylcyclopentyl)-1,3-dihydroinden-2-amine
PubChem CID114544662
Molecular FormulaC16H24N2
Molecular Weight244.38 g/mol
Exact Mass244.19
IUPAC Name2-(aminomethyl)-N-(3-methylcyclopentyl)-1,3-dihydroinden-2-amine
SMILESCC1CCC(NC2(CN)Cc3ccccc3C2)C1
InChIInChI=1S/C16H24N2/c1-12-6-7-15(8-12)18-16(11-17)9-13-4-2-3-5-14(13)10-16/h2-5,12,15,18H,6-11,17H2,1H3
InChIKeyOBVWERXJSBBWGI-UHFFFAOYSA-N
XLogP2.26
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-(3-methylcyclopentyl)-1,3-dihydroinden-2-amine?
The IUPAC name of 2-(aminomethyl)-N-(3-methylcyclopentyl)-1,3-dihydroinden-2-amine (CID 114544662) is 2-(aminomethyl)-N-(3-methylcyclopentyl)-1,3-dihydroinden-2-amine.
What is the SMILES notation for 2-(aminomethyl)-N-(3-methylcyclopentyl)-1,3-dihydroinden-2-amine?
The canonical SMILES for 2-(aminomethyl)-N-(3-methylcyclopentyl)-1,3-dihydroinden-2-amine is CC1CCC(NC2(CN)Cc3ccccc3C2)C1.
What is the InChIKey of 2-(aminomethyl)-N-(3-methylcyclopentyl)-1,3-dihydroinden-2-amine?
The InChIKey is OBVWERXJSBBWGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2/c1-12-6-7-15(8-12)18-16(11-17)9-13-4-2-3-5-14(13)10-16/h2-5,12,15,18H,6-11,17H2,1H3.
What are the key properties of 2-(aminomethyl)-N-(3-methylcyclopentyl)-1,3-dihydroinden-2-amine?
2-(aminomethyl)-N-(3-methylcyclopentyl)-1,3-dihydroinden-2-amine has a molecular weight of 244.38 g/mol, XLogP of 2.26, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-(3-methylcyclopentyl)-1,3-dihydroinden-2-amine is sourced from PubChem (CID 114544662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).