4-(aminomethyl)-1-methylspiro[6,7-dihydroindazole-5,1'-cyclopropane]-4-ol

C11H17N3O — CID 112716054

IUPAC4-(aminomethyl)-1-methylspiro[6,7-dihydroindazole-5,1'-cyclopropane]-4-ol
SMILESCn1ncc2c1CCC1(CC1)C2(O)CN
InChIInChI=1S/C11H17N3O/c1-14-9-2-3-10(4-5-10)11(15,7-12)8(9)6-13-14/h6,15H,2-5,7,12H2,1H3
InChIKeyFOJOWZJBJJRCGW-UHFFFAOYSA-N
MW207.28 g/mol
LogP0.29
Rot. Bonds1

About 4-(aminomethyl)-1-methylspiro[6,7-dihydroindazole-5,1'-cyclopropane]-4-ol

4-(aminomethyl)-1-methylspiro[6,7-dihydroindazole-5,1'-cyclopropane]-4-ol (PubChem CID 112716054) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 4-(aminomethyl)-1-methylspiro[6,7-dihydroindazole-5,1'-cyclopropane]-4-ol.

Molecular Properties

Compound Name4-(aminomethyl)-1-methylspiro[6,7-dihydroindazole-5,1'-cyclopropane]-4-ol
PubChem CID112716054
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name4-(aminomethyl)-1-methylspiro[6,7-dihydroindazole-5,1'-cyclopropane]-4-ol
SMILESCn1ncc2c1CCC1(CC1)C2(O)CN
InChIInChI=1S/C11H17N3O/c1-14-9-2-3-10(4-5-10)11(15,7-12)8(9)6-13-14/h6,15H,2-5,7,12H2,1H3
InChIKeyFOJOWZJBJJRCGW-UHFFFAOYSA-N
XLogP0.29
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-1-methylspiro[6,7-dihydroindazole-5,1'-cyclopropane]-4-ol?
The IUPAC name of 4-(aminomethyl)-1-methylspiro[6,7-dihydroindazole-5,1'-cyclopropane]-4-ol (CID 112716054) is 4-(aminomethyl)-1-methylspiro[6,7-dihydroindazole-5,1'-cyclopropane]-4-ol.
What is the SMILES notation for 4-(aminomethyl)-1-methylspiro[6,7-dihydroindazole-5,1'-cyclopropane]-4-ol?
The canonical SMILES for 4-(aminomethyl)-1-methylspiro[6,7-dihydroindazole-5,1'-cyclopropane]-4-ol is Cn1ncc2c1CCC1(CC1)C2(O)CN.
What is the InChIKey of 4-(aminomethyl)-1-methylspiro[6,7-dihydroindazole-5,1'-cyclopropane]-4-ol?
The InChIKey is FOJOWZJBJJRCGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-14-9-2-3-10(4-5-10)11(15,7-12)8(9)6-13-14/h6,15H,2-5,7,12H2,1H3.
What are the key properties of 4-(aminomethyl)-1-methylspiro[6,7-dihydroindazole-5,1'-cyclopropane]-4-ol?
4-(aminomethyl)-1-methylspiro[6,7-dihydroindazole-5,1'-cyclopropane]-4-ol has a molecular weight of 207.28 g/mol, XLogP of 0.29, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-1-methylspiro[6,7-dihydroindazole-5,1'-cyclopropane]-4-ol is sourced from PubChem (CID 112716054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).