1-[(2-methylcyclopropyl)amino]-2,3-dihydro-1H-inden-4-ol

C13H17NO — CID 62397315

IUPAC1-[(2-methylcyclopropyl)amino]-2,3-dihydro-1H-inden-4-ol
SMILESCC1CC1NC1CCc2c(O)cccc21
InChIInChI=1S/C13H17NO/c1-8-7-12(8)14-11-6-5-10-9(11)3-2-4-13(10)15/h2-4,8,11-12,14-15H,5-7H2,1H3
InChIKeyLAORVXUBDKBDKK-UHFFFAOYSA-N
MW203.28 g/mol
LogP2.38
Rot. Bonds2

About 1-[(2-methylcyclopropyl)amino]-2,3-dihydro-1H-inden-4-ol

1-[(2-methylcyclopropyl)amino]-2,3-dihydro-1H-inden-4-ol (PubChem CID 62397315) has the molecular formula C13H17NO and a molecular weight of 203.28 g/mol. Its IUPAC name is 1-[(2-methylcyclopropyl)amino]-2,3-dihydro-1H-inden-4-ol.

Molecular Properties

Compound Name1-[(2-methylcyclopropyl)amino]-2,3-dihydro-1H-inden-4-ol
PubChem CID62397315
Molecular FormulaC13H17NO
Molecular Weight203.28 g/mol
Exact Mass203.13
IUPAC Name1-[(2-methylcyclopropyl)amino]-2,3-dihydro-1H-inden-4-ol
SMILESCC1CC1NC1CCc2c(O)cccc21
InChIInChI=1S/C13H17NO/c1-8-7-12(8)14-11-6-5-10-9(11)3-2-4-13(10)15/h2-4,8,11-12,14-15H,5-7H2,1H3
InChIKeyLAORVXUBDKBDKK-UHFFFAOYSA-N
XLogP2.38
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.28
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[(2-methylcyclopropyl)amino]-2,3-dihydro-1H-inden-4-ol?
The IUPAC name of 1-[(2-methylcyclopropyl)amino]-2,3-dihydro-1H-inden-4-ol (CID 62397315) is 1-[(2-methylcyclopropyl)amino]-2,3-dihydro-1H-inden-4-ol.
What is the SMILES notation for 1-[(2-methylcyclopropyl)amino]-2,3-dihydro-1H-inden-4-ol?
The canonical SMILES for 1-[(2-methylcyclopropyl)amino]-2,3-dihydro-1H-inden-4-ol is CC1CC1NC1CCc2c(O)cccc21.
What is the InChIKey of 1-[(2-methylcyclopropyl)amino]-2,3-dihydro-1H-inden-4-ol?
The InChIKey is LAORVXUBDKBDKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO/c1-8-7-12(8)14-11-6-5-10-9(11)3-2-4-13(10)15/h2-4,8,11-12,14-15H,5-7H2,1H3.
What are the key properties of 1-[(2-methylcyclopropyl)amino]-2,3-dihydro-1H-inden-4-ol?
1-[(2-methylcyclopropyl)amino]-2,3-dihydro-1H-inden-4-ol has a molecular weight of 203.28 g/mol, XLogP of 2.38, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-methylcyclopropyl)amino]-2,3-dihydro-1H-inden-4-ol is sourced from PubChem (CID 62397315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).