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

C10H15N3O — CID 112715119

IUPAC4-(aminomethyl)spiro[6,7-dihydro-1H-indazole-5,1'-cyclopropane]-4-ol
SMILESNCC1(O)c2cn[nH]c2CCC12CC2
InChIInChI=1S/C10H15N3O/c11-6-10(14)7-5-12-13-8(7)1-2-9(10)3-4-9/h5,14H,1-4,6,11H2,(H,12,13)
InChIKeyZJGZZSDWHYIADZ-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.28
Rot. Bonds1

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

4-(aminomethyl)spiro[6,7-dihydro-1H-indazole-5,1'-cyclopropane]-4-ol (PubChem CID 112715119) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 4-(aminomethyl)spiro[6,7-dihydro-1H-indazole-5,1'-cyclopropane]-4-ol.

Molecular Properties

Compound Name4-(aminomethyl)spiro[6,7-dihydro-1H-indazole-5,1'-cyclopropane]-4-ol
PubChem CID112715119
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name4-(aminomethyl)spiro[6,7-dihydro-1H-indazole-5,1'-cyclopropane]-4-ol
SMILESNCC1(O)c2cn[nH]c2CCC12CC2
InChIInChI=1S/C10H15N3O/c11-6-10(14)7-5-12-13-8(7)1-2-9(10)3-4-9/h5,14H,1-4,6,11H2,(H,12,13)
InChIKeyZJGZZSDWHYIADZ-UHFFFAOYSA-N
XLogP0.28
TPSA74.93 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)spiro[6,7-dihydro-1H-indazole-5,1'-cyclopropane]-4-ol?
The IUPAC name of 4-(aminomethyl)spiro[6,7-dihydro-1H-indazole-5,1'-cyclopropane]-4-ol (CID 112715119) is 4-(aminomethyl)spiro[6,7-dihydro-1H-indazole-5,1'-cyclopropane]-4-ol.
What is the SMILES notation for 4-(aminomethyl)spiro[6,7-dihydro-1H-indazole-5,1'-cyclopropane]-4-ol?
The canonical SMILES for 4-(aminomethyl)spiro[6,7-dihydro-1H-indazole-5,1'-cyclopropane]-4-ol is NCC1(O)c2cn[nH]c2CCC12CC2.
What is the InChIKey of 4-(aminomethyl)spiro[6,7-dihydro-1H-indazole-5,1'-cyclopropane]-4-ol?
The InChIKey is ZJGZZSDWHYIADZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c11-6-10(14)7-5-12-13-8(7)1-2-9(10)3-4-9/h5,14H,1-4,6,11H2,(H,12,13).
What are the key properties of 4-(aminomethyl)spiro[6,7-dihydro-1H-indazole-5,1'-cyclopropane]-4-ol?
4-(aminomethyl)spiro[6,7-dihydro-1H-indazole-5,1'-cyclopropane]-4-ol has a molecular weight of 193.25 g/mol, XLogP of 0.28, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)spiro[6,7-dihydro-1H-indazole-5,1'-cyclopropane]-4-ol is sourced from PubChem (CID 112715119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).