N-(4-methylpentan-2-yl)-1H-indazol-6-amine

C13H19N3 — CID 43743502

IUPACN-(4-methylpentan-2-yl)-1H-indazol-6-amine
SMILESCC(C)CC(C)Nc1ccc2cn[nH]c2c1
InChIInChI=1S/C13H19N3/c1-9(2)6-10(3)15-12-5-4-11-8-14-16-13(11)7-12/h4-5,7-10,15H,6H2,1-3H3,(H,14,16)
InChIKeyBTPSZDLVGVIUPC-UHFFFAOYSA-N
MW217.32 g/mol
LogP3.41
Rot. Bonds4

About N-(4-methylpentan-2-yl)-1H-indazol-6-amine

N-(4-methylpentan-2-yl)-1H-indazol-6-amine (PubChem CID 43743502) has the molecular formula C13H19N3 and a molecular weight of 217.32 g/mol. Its IUPAC name is N-(4-methylpentan-2-yl)-1H-indazol-6-amine.

Molecular Properties

Compound NameN-(4-methylpentan-2-yl)-1H-indazol-6-amine
PubChem CID43743502
Molecular FormulaC13H19N3
Molecular Weight217.32 g/mol
Exact Mass217.16
IUPAC NameN-(4-methylpentan-2-yl)-1H-indazol-6-amine
SMILESCC(C)CC(C)Nc1ccc2cn[nH]c2c1
InChIInChI=1S/C13H19N3/c1-9(2)6-10(3)15-12-5-4-11-8-14-16-13(11)7-12/h4-5,7-10,15H,6H2,1-3H3,(H,14,16)
InChIKeyBTPSZDLVGVIUPC-UHFFFAOYSA-N
XLogP3.41
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.32
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-methylheptan-3-yl)-1H-indazol-6-amine
CID 43743481
N-[1-(1-methylcyclopropyl)ethyl]-1H-indazol-6-amine
CID 43743475
N-(2-methyl-1-thiophen-2-ylpropyl)-1H-indazol-6-amine
CID 43790617
N-(1H-indazol-6-yl)propane-2-sulfonamide
CID 25044387
N-[1-(2,4-difluorophenyl)ethyl]-1H-indazol-6-amine
CID 43743449
N'-(1H-indazol-6-yl)-N-(2-methylpropyl)oxamide
CID 108504895
N-[1-(5-chlorothiophen-2-yl)ethyl]-1H-indazol-6-amine
CID 43743466
N-[1-(4-bromothiophen-2-yl)ethyl]-1H-indazol-6-amine
CID 107354219
N-(3-methoxy-2-methylpropyl)-1H-indazol-6-amine
CID 116501115
N-[(4-propan-2-ylphenyl)methyl]-1H-indazol-6-amine
CID 43229901
N-(4-phenylbutan-2-yl)-1H-indazol-5-amine
CID 43690949
N-[(2R)-4-cyclopropylbutan-2-yl]-1H-indazol-5-amine
CID 99785141

Frequently Asked Questions

What is the IUPAC name of N-(4-methylpentan-2-yl)-1H-indazol-6-amine?
The IUPAC name of N-(4-methylpentan-2-yl)-1H-indazol-6-amine (CID 43743502) is N-(4-methylpentan-2-yl)-1H-indazol-6-amine.
What is the SMILES notation for N-(4-methylpentan-2-yl)-1H-indazol-6-amine?
The canonical SMILES for N-(4-methylpentan-2-yl)-1H-indazol-6-amine is CC(C)CC(C)Nc1ccc2cn[nH]c2c1.
What is the InChIKey of N-(4-methylpentan-2-yl)-1H-indazol-6-amine?
The InChIKey is BTPSZDLVGVIUPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3/c1-9(2)6-10(3)15-12-5-4-11-8-14-16-13(11)7-12/h4-5,7-10,15H,6H2,1-3H3,(H,14,16).
What are the key properties of N-(4-methylpentan-2-yl)-1H-indazol-6-amine?
N-(4-methylpentan-2-yl)-1H-indazol-6-amine has a molecular weight of 217.32 g/mol, XLogP of 3.41, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylpentan-2-yl)-1H-indazol-6-amine is sourced from PubChem (CID 43743502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).