7-(2-aminoethyl)spiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-ol

C11H17N3O — CID 112716057

IUPAC7-(2-aminoethyl)spiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-ol
SMILESNCCC1(O)c2[nH]ncc2CCC12CC2
InChIInChI=1S/C11H17N3O/c12-6-5-11(15)9-8(7-13-14-9)1-2-10(11)3-4-10/h7,15H,1-6,12H2,(H,13,14)
InChIKeyQKSPDBSOTSFIJM-UHFFFAOYSA-N
MW207.28 g/mol
LogP0.67
Rot. Bonds2

About 7-(2-aminoethyl)spiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-ol

7-(2-aminoethyl)spiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-ol (PubChem CID 112716057) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 7-(2-aminoethyl)spiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-ol.

Molecular Properties

Compound Name7-(2-aminoethyl)spiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-ol
PubChem CID112716057
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name7-(2-aminoethyl)spiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-ol
SMILESNCCC1(O)c2[nH]ncc2CCC12CC2
InChIInChI=1S/C11H17N3O/c12-6-5-11(15)9-8(7-13-14-9)1-2-10(11)3-4-10/h7,15H,1-6,12H2,(H,13,14)
InChIKeyQKSPDBSOTSFIJM-UHFFFAOYSA-N
XLogP0.67
TPSA74.93 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 7-(2-aminoethyl)spiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-ol with MolForge

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Related Compounds

6-propan-2-yl-4,5,6,7-tetrahydro-1H-indazol-7-ol
CID 129296491
6-ethyl-4,5,6,7-tetrahydro-1H-indazol-7-ol
CID 129296585
ethane;6-ethyl-4,5,6,7-tetrahydro-1H-indazol-7-ol
CID 145337729
6-methyl-4,5,6,7-tetrahydro-1H-indazol-7-ol
CID 145337813
7-(Aminomethyl)-1,4,5,6-tetrahydroindazol-7-ol
CID 83905565
4-(Aminomethyl)-1,5,6,7-tetrahydroindazol-4-ol
CID 83905567
7-(2-Aminoethyl)-1,4,5,6-tetrahydroindazol-7-ol
CID 83906524
4-(2-Aminoethyl)-1,5,6,7-tetrahydroindazol-4-ol
CID 83906525
7-(Aminomethyl)-6-methyl-1,4,5,6-tetrahydroindazol-7-ol
CID 112714735
4-(Aminomethyl)-5-methyl-1,5,6,7-tetrahydroindazol-4-ol
CID 112714737
7-(aminomethyl)spiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-ol
CID 112715118
4-(aminomethyl)spiro[6,7-dihydro-1H-indazole-5,1'-cyclopropane]-4-ol
CID 112715119

Frequently Asked Questions

What is the IUPAC name of 7-(2-aminoethyl)spiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-ol?
The IUPAC name of 7-(2-aminoethyl)spiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-ol (CID 112716057) is 7-(2-aminoethyl)spiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-ol.
What is the SMILES notation for 7-(2-aminoethyl)spiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-ol?
The canonical SMILES for 7-(2-aminoethyl)spiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-ol is NCCC1(O)c2[nH]ncc2CCC12CC2.
What is the InChIKey of 7-(2-aminoethyl)spiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-ol?
The InChIKey is QKSPDBSOTSFIJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c12-6-5-11(15)9-8(7-13-14-9)1-2-10(11)3-4-10/h7,15H,1-6,12H2,(H,13,14).
What are the key properties of 7-(2-aminoethyl)spiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-ol?
7-(2-aminoethyl)spiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-ol has a molecular weight of 207.28 g/mol, XLogP of 0.67, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2-aminoethyl)spiro[4,5-dihydro-1H-indazole-6,1'-cyclopropane]-7-ol is sourced from PubChem (CID 112716057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).