1-[(3-methylcyclobutyl)amino]-2,3-dihydro-1H-inden-5-ol

C14H19NO — CID 107682661

IUPAC1-[(3-methylcyclobutyl)amino]-2,3-dihydro-1H-inden-5-ol
SMILESCC1CC(NC2CCc3cc(O)ccc32)C1
InChIInChI=1S/C14H19NO/c1-9-6-11(7-9)15-14-5-2-10-8-12(16)3-4-13(10)14/h3-4,8-9,11,14-16H,2,5-7H2,1H3
InChIKeyMELAHPLAORIKKT-UHFFFAOYSA-N
MW217.31 g/mol
LogP2.77
Rot. Bonds2

About 1-[(3-methylcyclobutyl)amino]-2,3-dihydro-1H-inden-5-ol

1-[(3-methylcyclobutyl)amino]-2,3-dihydro-1H-inden-5-ol (PubChem CID 107682661) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is 1-[(3-methylcyclobutyl)amino]-2,3-dihydro-1H-inden-5-ol.

Molecular Properties

Compound Name1-[(3-methylcyclobutyl)amino]-2,3-dihydro-1H-inden-5-ol
PubChem CID107682661
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name1-[(3-methylcyclobutyl)amino]-2,3-dihydro-1H-inden-5-ol
SMILESCC1CC(NC2CCc3cc(O)ccc32)C1
InChIInChI=1S/C14H19NO/c1-9-6-11(7-9)15-14-5-2-10-8-12(16)3-4-13(10)14/h3-4,8-9,11,14-16H,2,5-7H2,1H3
InChIKeyMELAHPLAORIKKT-UHFFFAOYSA-N
XLogP2.77
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-[(3-methylcyclobutyl)amino]-2,3-dihydro-1H-inden-5-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[(4-hydroxycyclohexyl)amino]-2,3-dihydro-1H-inden-5-ol
CID 107682715
1-[(3-methoxycyclopentyl)amino]-2,3-dihydro-1H-inden-5-ol
CID 114117955
6-chloro-N-(3-methylcyclobutyl)-2,3-dihydro-1H-inden-1-amine
CID 115892348
1-[(1-propylpiperidin-4-yl)amino]-2,3-dihydro-1H-inden-5-ol
CID 107681901
1-(methoxyamino)-2,3-dihydro-1H-inden-5-ol
CID 103847278
1-(4-hydroxy-2-methylanilino)-2,3-dihydro-1H-inden-5-ol
CID 107682398
1-(1-cyclohexylethylamino)-2,3-dihydro-1H-inden-5-ol
CID 107682320
1-(4-hydroxy-2,5-dimethylanilino)-2,3-dihydro-1H-inden-5-ol
CID 107682735
tert-butyl N-[2-[(5-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]cyclopropyl]carbamate
CID 107682742
1-(3,4-dihydro-2H-thiochromen-4-ylamino)-2,3-dihydro-1H-inden-5-ol
CID 107682115
1-[1-(2,6-difluorophenyl)ethylamino]-2,3-dihydro-1H-inden-5-ol
CID 107682182
1-(4-bromo-2,6-dimethylanilino)-2,3-dihydro-1H-inden-5-ol
CID 107682184

Frequently Asked Questions

What is the IUPAC name of 1-[(3-methylcyclobutyl)amino]-2,3-dihydro-1H-inden-5-ol?
The IUPAC name of 1-[(3-methylcyclobutyl)amino]-2,3-dihydro-1H-inden-5-ol (CID 107682661) is 1-[(3-methylcyclobutyl)amino]-2,3-dihydro-1H-inden-5-ol.
What is the SMILES notation for 1-[(3-methylcyclobutyl)amino]-2,3-dihydro-1H-inden-5-ol?
The canonical SMILES for 1-[(3-methylcyclobutyl)amino]-2,3-dihydro-1H-inden-5-ol is CC1CC(NC2CCc3cc(O)ccc32)C1.
What is the InChIKey of 1-[(3-methylcyclobutyl)amino]-2,3-dihydro-1H-inden-5-ol?
The InChIKey is MELAHPLAORIKKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-9-6-11(7-9)15-14-5-2-10-8-12(16)3-4-13(10)14/h3-4,8-9,11,14-16H,2,5-7H2,1H3.
What are the key properties of 1-[(3-methylcyclobutyl)amino]-2,3-dihydro-1H-inden-5-ol?
1-[(3-methylcyclobutyl)amino]-2,3-dihydro-1H-inden-5-ol has a molecular weight of 217.31 g/mol, XLogP of 2.77, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-methylcyclobutyl)amino]-2,3-dihydro-1H-inden-5-ol is sourced from PubChem (CID 107682661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).