(2-methylspiro[6,7-dihydro-4H-indazole-5,1'-cyclopropane]-4-yl)methanamine

C11H17N3 — CID 112715000

IUPAC(2-methylspiro[6,7-dihydro-4H-indazole-5,1'-cyclopropane]-4-yl)methanamine
SMILESCn1cc2c(n1)CCC1(CC1)C2CN
InChIInChI=1S/C11H17N3/c1-14-7-8-9(6-12)11(4-5-11)3-2-10(8)13-14/h7,9H,2-6,12H2,1H3
InChIKeyBUFSRILRKOYXLE-UHFFFAOYSA-N
MW191.28 g/mol
LogP1.19
Rot. Bonds1

About (2-methylspiro[6,7-dihydro-4H-indazole-5,1'-cyclopropane]-4-yl)methanamine

(2-methylspiro[6,7-dihydro-4H-indazole-5,1'-cyclopropane]-4-yl)methanamine (PubChem CID 112715000) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is (2-methylspiro[6,7-dihydro-4H-indazole-5,1'-cyclopropane]-4-yl)methanamine.

Molecular Properties

Compound Name(2-methylspiro[6,7-dihydro-4H-indazole-5,1'-cyclopropane]-4-yl)methanamine
PubChem CID112715000
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name(2-methylspiro[6,7-dihydro-4H-indazole-5,1'-cyclopropane]-4-yl)methanamine
SMILESCn1cc2c(n1)CCC1(CC1)C2CN
InChIInChI=1S/C11H17N3/c1-14-7-8-9(6-12)11(4-5-11)3-2-10(8)13-14/h7,9H,2-6,12H2,1H3
InChIKeyBUFSRILRKOYXLE-UHFFFAOYSA-N
XLogP1.19
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1-methylspiro[5,7-dihydro-4H-indazole-6,1'-cyclopropane]-7-yl)methanamine
CID 112714996
spiro[6,7-dihydro-4H-1,2-benzoxazole-5,1'-cyclopropane]-4-ylmethanamine
CID 112714534
[(4R)-2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-4-yl]methanol
CID 124676721
(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-4-yl)methanol
CID 119053634
(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-5-yl)methanamine
CID 82417278
2,5-dimethyl-4,5,6,7-tetrahydroindazole-4-carboxylic acid
CID 112715296
[2-(1,3-dimethylpyrazol-4-yl)cyclopropyl]methanamine
CID 83094405
4-hydroxy-2-methyl-5,6-dihydrocyclopenta[c]pyrazole-4-carboxylic acid
CID 83906646
[5-(1,3-dimethylpyrazol-4-yl)oxolan-2-yl]methanamine
CID 130583637
(2S)-1-[[(4R)-2-methyl-4,5,6,7-tetrahydroindazol-4-yl]amino]propan-2-ol
CID 100638267
(2R)-1-[[(4R)-2-methyl-4,5,6,7-tetrahydroindazol-4-yl]amino]propan-2-ol
CID 100638279
[1-(aminomethyl)-2-(3-ethyl-1-methylpyrazol-4-yl)cyclopropyl]methanol
CID 112671144

Frequently Asked Questions

What is the IUPAC name of (2-methylspiro[6,7-dihydro-4H-indazole-5,1'-cyclopropane]-4-yl)methanamine?
The IUPAC name of (2-methylspiro[6,7-dihydro-4H-indazole-5,1'-cyclopropane]-4-yl)methanamine (CID 112715000) is (2-methylspiro[6,7-dihydro-4H-indazole-5,1'-cyclopropane]-4-yl)methanamine.
What is the SMILES notation for (2-methylspiro[6,7-dihydro-4H-indazole-5,1'-cyclopropane]-4-yl)methanamine?
The canonical SMILES for (2-methylspiro[6,7-dihydro-4H-indazole-5,1'-cyclopropane]-4-yl)methanamine is Cn1cc2c(n1)CCC1(CC1)C2CN.
What is the InChIKey of (2-methylspiro[6,7-dihydro-4H-indazole-5,1'-cyclopropane]-4-yl)methanamine?
The InChIKey is BUFSRILRKOYXLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-14-7-8-9(6-12)11(4-5-11)3-2-10(8)13-14/h7,9H,2-6,12H2,1H3.
What are the key properties of (2-methylspiro[6,7-dihydro-4H-indazole-5,1'-cyclopropane]-4-yl)methanamine?
(2-methylspiro[6,7-dihydro-4H-indazole-5,1'-cyclopropane]-4-yl)methanamine has a molecular weight of 191.28 g/mol, XLogP of 1.19, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylspiro[6,7-dihydro-4H-indazole-5,1'-cyclopropane]-4-yl)methanamine is sourced from PubChem (CID 112715000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).