N-cyclopropyl-1-methyl-4,5,6,7-tetrahydroindazol-7-amine

C11H17N3 — CID 83907429

IUPACN-cyclopropyl-1-methyl-4,5,6,7-tetrahydroindazol-7-amine
SMILESCn1ncc2c1C(NC1CC1)CCC2
InChIInChI=1S/C11H17N3/c1-14-11-8(7-12-14)3-2-4-10(11)13-9-5-6-9/h7,9-10,13H,2-6H2,1H3
InChIKeyASNOPEBMXGUHHY-UHFFFAOYSA-N
MW191.28 g/mol
LogP1.55
Rot. Bonds2

About N-cyclopropyl-1-methyl-4,5,6,7-tetrahydroindazol-7-amine

N-cyclopropyl-1-methyl-4,5,6,7-tetrahydroindazol-7-amine (PubChem CID 83907429) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is N-cyclopropyl-1-methyl-4,5,6,7-tetrahydroindazol-7-amine.

Molecular Properties

Compound NameN-cyclopropyl-1-methyl-4,5,6,7-tetrahydroindazol-7-amine
PubChem CID83907429
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC NameN-cyclopropyl-1-methyl-4,5,6,7-tetrahydroindazol-7-amine
SMILESCn1ncc2c1C(NC1CC1)CCC2
InChIInChI=1S/C11H17N3/c1-14-11-8(7-12-14)3-2-4-10(11)13-9-5-6-9/h7,9-10,13H,2-6H2,1H3
InChIKeyASNOPEBMXGUHHY-UHFFFAOYSA-N
XLogP1.55
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-methyl-4,5,6,7-tetrahydroindazol-7-amine?
The IUPAC name of N-cyclopropyl-1-methyl-4,5,6,7-tetrahydroindazol-7-amine (CID 83907429) is N-cyclopropyl-1-methyl-4,5,6,7-tetrahydroindazol-7-amine.
What is the SMILES notation for N-cyclopropyl-1-methyl-4,5,6,7-tetrahydroindazol-7-amine?
The canonical SMILES for N-cyclopropyl-1-methyl-4,5,6,7-tetrahydroindazol-7-amine is Cn1ncc2c1C(NC1CC1)CCC2.
What is the InChIKey of N-cyclopropyl-1-methyl-4,5,6,7-tetrahydroindazol-7-amine?
The InChIKey is ASNOPEBMXGUHHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-14-11-8(7-12-14)3-2-4-10(11)13-9-5-6-9/h7,9-10,13H,2-6H2,1H3.
What are the key properties of N-cyclopropyl-1-methyl-4,5,6,7-tetrahydroindazol-7-amine?
N-cyclopropyl-1-methyl-4,5,6,7-tetrahydroindazol-7-amine has a molecular weight of 191.28 g/mol, XLogP of 1.55, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-methyl-4,5,6,7-tetrahydroindazol-7-amine is sourced from PubChem (CID 83907429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).