5-(aminomethyl)-2,3-dihydro-1H-inden-1-ol

C10H13NO — CID 53439054

IUPAC5-(aminomethyl)-2,3-dihydro-1H-inden-1-ol
SMILESNCc1ccc2c(c1)CCC2O
InChIInChI=1S/C10H13NO/c11-6-7-1-3-9-8(5-7)2-4-10(9)12/h1,3,5,10,12H,2,4,6,11H2
InChIKeyMUUWCBRAVNOUBY-UHFFFAOYSA-N
MW163.22 g/mol
LogP1.12
Rot. Bonds1

About 5-(aminomethyl)-2,3-dihydro-1H-inden-1-ol

5-(aminomethyl)-2,3-dihydro-1H-inden-1-ol (PubChem CID 53439054) has the molecular formula C10H13NO and a molecular weight of 163.22 g/mol. Its IUPAC name is 5-(aminomethyl)-2,3-dihydro-1H-inden-1-ol.

Molecular Properties

Compound Name5-(aminomethyl)-2,3-dihydro-1H-inden-1-ol
PubChem CID53439054
Molecular FormulaC10H13NO
Molecular Weight163.22 g/mol
Exact Mass163.10
IUPAC Name5-(aminomethyl)-2,3-dihydro-1H-inden-1-ol
SMILESNCc1ccc2c(c1)CCC2O
InChIInChI=1S/C10H13NO/c11-6-7-1-3-9-8(5-7)2-4-10(9)12/h1,3,5,10,12H,2,4,6,11H2
InChIKeyMUUWCBRAVNOUBY-UHFFFAOYSA-N
XLogP1.12
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-2,3-dihydro-1H-inden-1-ol?
The IUPAC name of 5-(aminomethyl)-2,3-dihydro-1H-inden-1-ol (CID 53439054) is 5-(aminomethyl)-2,3-dihydro-1H-inden-1-ol.
What is the SMILES notation for 5-(aminomethyl)-2,3-dihydro-1H-inden-1-ol?
The canonical SMILES for 5-(aminomethyl)-2,3-dihydro-1H-inden-1-ol is NCc1ccc2c(c1)CCC2O.
What is the InChIKey of 5-(aminomethyl)-2,3-dihydro-1H-inden-1-ol?
The InChIKey is MUUWCBRAVNOUBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO/c11-6-7-1-3-9-8(5-7)2-4-10(9)12/h1,3,5,10,12H,2,4,6,11H2.
What are the key properties of 5-(aminomethyl)-2,3-dihydro-1H-inden-1-ol?
5-(aminomethyl)-2,3-dihydro-1H-inden-1-ol has a molecular weight of 163.22 g/mol, XLogP of 1.12, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-2,3-dihydro-1H-inden-1-ol is sourced from PubChem (CID 53439054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).