N-(2-pyrrolidin-2-ylcyclohexyl)-1H-indazol-5-amine

C17H24N4 — CID 79536417

IUPACN-(2-pyrrolidin-2-ylcyclohexyl)-1H-indazol-5-amine
SMILESc1cc2[nH]ncc2cc1NC1CCCCC1C1CCCN1
InChIInChI=1S/C17H24N4/c1-2-5-17(14(4-1)16-6-3-9-18-16)20-13-7-8-15-12(10-13)11-19-21-15/h7-8,10-11,14,16-18,20H,1-6,9H2,(H,19,21)
InChIKeyNMTIKLMASIRQQJ-UHFFFAOYSA-N
MW284.41 g/mol
LogP3.29
Rot. Bonds3

About N-(2-pyrrolidin-2-ylcyclohexyl)-1H-indazol-5-amine

N-(2-pyrrolidin-2-ylcyclohexyl)-1H-indazol-5-amine (PubChem CID 79536417) has the molecular formula C17H24N4 and a molecular weight of 284.41 g/mol. Its IUPAC name is N-(2-pyrrolidin-2-ylcyclohexyl)-1H-indazol-5-amine.

Molecular Properties

Compound NameN-(2-pyrrolidin-2-ylcyclohexyl)-1H-indazol-5-amine
PubChem CID79536417
Molecular FormulaC17H24N4
Molecular Weight284.41 g/mol
Exact Mass284.20
IUPAC NameN-(2-pyrrolidin-2-ylcyclohexyl)-1H-indazol-5-amine
SMILESc1cc2[nH]ncc2cc1NC1CCCCC1C1CCCN1
InChIInChI=1S/C17H24N4/c1-2-5-17(14(4-1)16-6-3-9-18-16)20-13-7-8-15-12(10-13)11-19-21-15/h7-8,10-11,14,16-18,20H,1-6,9H2,(H,19,21)
InChIKeyNMTIKLMASIRQQJ-UHFFFAOYSA-N
XLogP3.29
TPSA52.74 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.41
LogP ≤ 53.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-pyrrolidin-2-ylcyclohexyl)-1H-indazol-5-amine?
The IUPAC name of N-(2-pyrrolidin-2-ylcyclohexyl)-1H-indazol-5-amine (CID 79536417) is N-(2-pyrrolidin-2-ylcyclohexyl)-1H-indazol-5-amine.
What is the SMILES notation for N-(2-pyrrolidin-2-ylcyclohexyl)-1H-indazol-5-amine?
The canonical SMILES for N-(2-pyrrolidin-2-ylcyclohexyl)-1H-indazol-5-amine is c1cc2[nH]ncc2cc1NC1CCCCC1C1CCCN1.
What is the InChIKey of N-(2-pyrrolidin-2-ylcyclohexyl)-1H-indazol-5-amine?
The InChIKey is NMTIKLMASIRQQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4/c1-2-5-17(14(4-1)16-6-3-9-18-16)20-13-7-8-15-12(10-13)11-19-21-15/h7-8,10-11,14,16-18,20H,1-6,9H2,(H,19,21).
What are the key properties of N-(2-pyrrolidin-2-ylcyclohexyl)-1H-indazol-5-amine?
N-(2-pyrrolidin-2-ylcyclohexyl)-1H-indazol-5-amine has a molecular weight of 284.41 g/mol, XLogP of 3.29, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-pyrrolidin-2-ylcyclohexyl)-1H-indazol-5-amine is sourced from PubChem (CID 79536417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).