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

C14H22N2O — CID 102697309

IUPAC2-(aminomethyl)-N-(2-methoxypropyl)-1,3-dihydroinden-2-amine
SMILESCOC(C)CNC1(CN)Cc2ccccc2C1
InChIInChI=1S/C14H22N2O/c1-11(17-2)9-16-14(10-15)7-12-5-3-4-6-13(12)8-14/h3-6,11,16H,7-10,15H2,1-2H3
InChIKeyNOFKVAWSPLAAJQ-UHFFFAOYSA-N
MW234.34 g/mol
LogP1.11
Rot. Bonds5

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

2-(aminomethyl)-N-(2-methoxypropyl)-1,3-dihydroinden-2-amine (PubChem CID 102697309) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 2-(aminomethyl)-N-(2-methoxypropyl)-1,3-dihydroinden-2-amine.

Molecular Properties

Compound Name2-(aminomethyl)-N-(2-methoxypropyl)-1,3-dihydroinden-2-amine
PubChem CID102697309
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name2-(aminomethyl)-N-(2-methoxypropyl)-1,3-dihydroinden-2-amine
SMILESCOC(C)CNC1(CN)Cc2ccccc2C1
InChIInChI=1S/C14H22N2O/c1-11(17-2)9-16-14(10-15)7-12-5-3-4-6-13(12)8-14/h3-6,11,16H,7-10,15H2,1-2H3
InChIKeyNOFKVAWSPLAAJQ-UHFFFAOYSA-N
XLogP1.11
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-(2-methoxypropyl)-1,3-dihydroinden-2-amine?
The IUPAC name of 2-(aminomethyl)-N-(2-methoxypropyl)-1,3-dihydroinden-2-amine (CID 102697309) is 2-(aminomethyl)-N-(2-methoxypropyl)-1,3-dihydroinden-2-amine.
What is the SMILES notation for 2-(aminomethyl)-N-(2-methoxypropyl)-1,3-dihydroinden-2-amine?
The canonical SMILES for 2-(aminomethyl)-N-(2-methoxypropyl)-1,3-dihydroinden-2-amine is COC(C)CNC1(CN)Cc2ccccc2C1.
What is the InChIKey of 2-(aminomethyl)-N-(2-methoxypropyl)-1,3-dihydroinden-2-amine?
The InChIKey is NOFKVAWSPLAAJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-11(17-2)9-16-14(10-15)7-12-5-3-4-6-13(12)8-14/h3-6,11,16H,7-10,15H2,1-2H3.
What are the key properties of 2-(aminomethyl)-N-(2-methoxypropyl)-1,3-dihydroinden-2-amine?
2-(aminomethyl)-N-(2-methoxypropyl)-1,3-dihydroinden-2-amine has a molecular weight of 234.34 g/mol, XLogP of 1.11, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-(2-methoxypropyl)-1,3-dihydroinden-2-amine is sourced from PubChem (CID 102697309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).