1-[2-(1-methylimidazol-2-yl)ethylamino]-2,3-dihydro-1H-inden-5-ol

C15H19N3O — CID 107682234

IUPAC1-[2-(1-methylimidazol-2-yl)ethylamino]-2,3-dihydro-1H-inden-5-ol
SMILESCn1ccnc1CCNC1CCc2cc(O)ccc21
InChIInChI=1S/C15H19N3O/c1-18-9-8-17-15(18)6-7-16-14-5-2-11-10-12(19)3-4-13(11)14/h3-4,8-10,14,16,19H,2,5-7H2,1H3
InChIKeyLXGZYSUHQHRCOQ-UHFFFAOYSA-N
MW257.34 g/mol
LogP1.95
Rot. Bonds4

About 1-[2-(1-methylimidazol-2-yl)ethylamino]-2,3-dihydro-1H-inden-5-ol

1-[2-(1-methylimidazol-2-yl)ethylamino]-2,3-dihydro-1H-inden-5-ol (PubChem CID 107682234) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 1-[2-(1-methylimidazol-2-yl)ethylamino]-2,3-dihydro-1H-inden-5-ol.

Molecular Properties

Compound Name1-[2-(1-methylimidazol-2-yl)ethylamino]-2,3-dihydro-1H-inden-5-ol
PubChem CID107682234
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name1-[2-(1-methylimidazol-2-yl)ethylamino]-2,3-dihydro-1H-inden-5-ol
SMILESCn1ccnc1CCNC1CCc2cc(O)ccc21
InChIInChI=1S/C15H19N3O/c1-18-9-8-17-15(18)6-7-16-14-5-2-11-10-12(19)3-4-13(11)14/h3-4,8-10,14,16,19H,2,5-7H2,1H3
InChIKeyLXGZYSUHQHRCOQ-UHFFFAOYSA-N
XLogP1.95
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(1-methylimidazol-2-yl)ethyl]-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 61215276
1-[2-(1,3-thiazol-4-yl)ethylamino]-2,3-dihydro-1H-inden-5-ol
CID 107682370
1-[2-(3-methylphenyl)ethylamino]-2,3-dihydro-1H-inden-5-ol
CID 107682315
N-[2-(1-methylimidazol-2-yl)ethyl]-4,5,6,7-tetrahydro-1-benzothiophen-4-amine
CID 62841791
N-[2-(1-methylimidazol-2-yl)ethyl]-1,2,3,4-tetrahydronaphthalen-2-amine
CID 61211277
1-[2-[cyclopropyl(methyl)amino]ethylamino]-2,3-dihydro-1H-inden-5-ol
CID 107682345
1-(2-methylsulfinylethylamino)-2,3-dihydro-1H-inden-5-ol
CID 107682669
1-(4-aminobutylamino)-2,3-dihydro-1H-inden-5-ol
CID 107682163
1-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethylamino)-2,3-dihydro-1H-inden-5-ol
CID 107681897
N-[2-(1-methylimidazol-2-yl)ethyl]-1,1-dioxo-3,4-dihydro-2H-thiochromen-4-amine
CID 61211656
1-[(2-ethyl-2-hydroxybutyl)amino]-2,3-dihydro-1H-inden-5-ol
CID 107682417
N-[2-(1-methylimidazol-2-yl)ethyl]cyclooctanamine
CID 61214993

Frequently Asked Questions

What is the IUPAC name of 1-[2-(1-methylimidazol-2-yl)ethylamino]-2,3-dihydro-1H-inden-5-ol?
The IUPAC name of 1-[2-(1-methylimidazol-2-yl)ethylamino]-2,3-dihydro-1H-inden-5-ol (CID 107682234) is 1-[2-(1-methylimidazol-2-yl)ethylamino]-2,3-dihydro-1H-inden-5-ol.
What is the SMILES notation for 1-[2-(1-methylimidazol-2-yl)ethylamino]-2,3-dihydro-1H-inden-5-ol?
The canonical SMILES for 1-[2-(1-methylimidazol-2-yl)ethylamino]-2,3-dihydro-1H-inden-5-ol is Cn1ccnc1CCNC1CCc2cc(O)ccc21.
What is the InChIKey of 1-[2-(1-methylimidazol-2-yl)ethylamino]-2,3-dihydro-1H-inden-5-ol?
The InChIKey is LXGZYSUHQHRCOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-18-9-8-17-15(18)6-7-16-14-5-2-11-10-12(19)3-4-13(11)14/h3-4,8-10,14,16,19H,2,5-7H2,1H3.
What are the key properties of 1-[2-(1-methylimidazol-2-yl)ethylamino]-2,3-dihydro-1H-inden-5-ol?
1-[2-(1-methylimidazol-2-yl)ethylamino]-2,3-dihydro-1H-inden-5-ol has a molecular weight of 257.34 g/mol, XLogP of 1.95, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(1-methylimidazol-2-yl)ethylamino]-2,3-dihydro-1H-inden-5-ol is sourced from PubChem (CID 107682234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).