(1-amino-2,3-dihydroinden-1-yl)methanol

C10H13NO — CID 10702154

IUPAC(1-amino-2,3-dihydroinden-1-yl)methanol
SMILESNC1(CO)CCc2ccccc21
InChIInChI=1S/C10H13NO/c11-10(7-12)6-5-8-3-1-2-4-9(8)10/h1-4,12H,5-7,11H2
InChIKeySHSCRKXSHFWZSL-UHFFFAOYSA-N
MW163.22 g/mol
LogP0.78
Rot. Bonds1

About (1-amino-2,3-dihydroinden-1-yl)methanol

(1-amino-2,3-dihydroinden-1-yl)methanol (PubChem CID 10702154) has the molecular formula C10H13NO and a molecular weight of 163.22 g/mol. Its IUPAC name is (1-amino-2,3-dihydroinden-1-yl)methanol.

Molecular Properties

Compound Name(1-amino-2,3-dihydroinden-1-yl)methanol
PubChem CID10702154
Molecular FormulaC10H13NO
Molecular Weight163.22 g/mol
Exact Mass163.10
IUPAC Name(1-amino-2,3-dihydroinden-1-yl)methanol
SMILESNC1(CO)CCc2ccccc21
InChIInChI=1S/C10H13NO/c11-10(7-12)6-5-8-3-1-2-4-9(8)10/h1-4,12H,5-7,11H2
InChIKeySHSCRKXSHFWZSL-UHFFFAOYSA-N
XLogP0.78
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 ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1-amino-2,3-dihydroinden-1-yl)methanol?
The IUPAC name of (1-amino-2,3-dihydroinden-1-yl)methanol (CID 10702154) is (1-amino-2,3-dihydroinden-1-yl)methanol.
What is the SMILES notation for (1-amino-2,3-dihydroinden-1-yl)methanol?
The canonical SMILES for (1-amino-2,3-dihydroinden-1-yl)methanol is NC1(CO)CCc2ccccc21.
What is the InChIKey of (1-amino-2,3-dihydroinden-1-yl)methanol?
The InChIKey is SHSCRKXSHFWZSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO/c11-10(7-12)6-5-8-3-1-2-4-9(8)10/h1-4,12H,5-7,11H2.
What are the key properties of (1-amino-2,3-dihydroinden-1-yl)methanol?
(1-amino-2,3-dihydroinden-1-yl)methanol has a molecular weight of 163.22 g/mol, XLogP of 0.78, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-amino-2,3-dihydroinden-1-yl)methanol is sourced from PubChem (CID 10702154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).