1-[(1-propan-2-ylpyrazol-4-yl)amino]-2,3-dihydro-1H-inden-5-ol

C15H19N3O — CID 107682342

IUPAC1-[(1-propan-2-ylpyrazol-4-yl)amino]-2,3-dihydro-1H-inden-5-ol
SMILESCC(C)n1cc(NC2CCc3cc(O)ccc32)cn1
InChIInChI=1S/C15H19N3O/c1-10(2)18-9-12(8-16-18)17-15-6-3-11-7-13(19)4-5-14(11)15/h4-5,7-10,15,17,19H,3,6H2,1-2H3
InChIKeyDOUUHKVSJFYGBV-UHFFFAOYSA-N
MW257.34 g/mol
LogP3.27
Rot. Bonds3

About 1-[(1-propan-2-ylpyrazol-4-yl)amino]-2,3-dihydro-1H-inden-5-ol

1-[(1-propan-2-ylpyrazol-4-yl)amino]-2,3-dihydro-1H-inden-5-ol (PubChem CID 107682342) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 1-[(1-propan-2-ylpyrazol-4-yl)amino]-2,3-dihydro-1H-inden-5-ol.

Molecular Properties

Compound Name1-[(1-propan-2-ylpyrazol-4-yl)amino]-2,3-dihydro-1H-inden-5-ol
PubChem CID107682342
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name1-[(1-propan-2-ylpyrazol-4-yl)amino]-2,3-dihydro-1H-inden-5-ol
SMILESCC(C)n1cc(NC2CCc3cc(O)ccc32)cn1
InChIInChI=1S/C15H19N3O/c1-10(2)18-9-12(8-16-18)17-15-6-3-11-7-13(19)4-5-14(11)15/h4-5,7-10,15,17,19H,3,6H2,1-2H3
InChIKeyDOUUHKVSJFYGBV-UHFFFAOYSA-N
XLogP3.27
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-bromoanilino)-2,3-dihydro-1H-inden-5-ol
CID 107681800
1-[[6-(dimethylamino)-3-pyridinyl]amino]-2,3-dihydro-1H-inden-5-ol
CID 107682026
5-(pyrimidin-5-ylamino)-5,6,7,8-tetrahydronaphthalen-2-ol
CID 107588220
1-ethyl-5-[(5-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]pyridin-2-one
CID 107682187
1-[[6-(trifluoromethyl)-3-pyridinyl]amino]-2,3-dihydro-1H-inden-5-ol
CID 107682586
1-(4-hydroxy-2-methylanilino)-2,3-dihydro-1H-inden-5-ol
CID 107682398
1-[4-(difluoromethoxy)anilino]-2,3-dihydro-1H-inden-5-ol
CID 107681840
4-[(5-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]-N-methylbenzamide
CID 107682006
N-(6-bromo-1,2,3,4-tetrahydronaphthalen-2-yl)-1-propan-2-ylpyrazol-4-amine
CID 63627298
N-(oxan-4-yl)-1-propan-2-ylpyrazol-4-amine
CID 62903541
1-(4-bromo-2,6-dimethylanilino)-2,3-dihydro-1H-inden-5-ol
CID 107682184
methyl 3-[(5-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]benzoate
CID 107681939

Frequently Asked Questions

What is the IUPAC name of 1-[(1-propan-2-ylpyrazol-4-yl)amino]-2,3-dihydro-1H-inden-5-ol?
The IUPAC name of 1-[(1-propan-2-ylpyrazol-4-yl)amino]-2,3-dihydro-1H-inden-5-ol (CID 107682342) is 1-[(1-propan-2-ylpyrazol-4-yl)amino]-2,3-dihydro-1H-inden-5-ol.
What is the SMILES notation for 1-[(1-propan-2-ylpyrazol-4-yl)amino]-2,3-dihydro-1H-inden-5-ol?
The canonical SMILES for 1-[(1-propan-2-ylpyrazol-4-yl)amino]-2,3-dihydro-1H-inden-5-ol is CC(C)n1cc(NC2CCc3cc(O)ccc32)cn1.
What is the InChIKey of 1-[(1-propan-2-ylpyrazol-4-yl)amino]-2,3-dihydro-1H-inden-5-ol?
The InChIKey is DOUUHKVSJFYGBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-10(2)18-9-12(8-16-18)17-15-6-3-11-7-13(19)4-5-14(11)15/h4-5,7-10,15,17,19H,3,6H2,1-2H3.
What are the key properties of 1-[(1-propan-2-ylpyrazol-4-yl)amino]-2,3-dihydro-1H-inden-5-ol?
1-[(1-propan-2-ylpyrazol-4-yl)amino]-2,3-dihydro-1H-inden-5-ol has a molecular weight of 257.34 g/mol, XLogP of 3.27, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1-propan-2-ylpyrazol-4-yl)amino]-2,3-dihydro-1H-inden-5-ol is sourced from PubChem (CID 107682342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).