N-(5-methyl-3-piperidin-1-ylhexyl)-1H-indazol-3-amine

C19H30N4 — CID 3021347

IUPACN-(5-methyl-3-piperidin-1-ylhexyl)-1H-indazol-3-amine
SMILESCC(C)CC(CCNc1n[nH]c2ccccc12)N1CCCCC1
InChIInChI=1S/C19H30N4/c1-15(2)14-16(23-12-6-3-7-13-23)10-11-20-19-17-8-4-5-9-18(17)21-22-19/h4-5,8-9,15-16H,3,6-7,10-14H2,1-2H3,(H2,20,21,22)
InChIKeyXFXBHOVYUBIUIK-UHFFFAOYSA-N
MW314.48 g/mol
LogP4.27
Rot. Bonds7

About N-(5-methyl-3-piperidin-1-ylhexyl)-1H-indazol-3-amine

N-(5-methyl-3-piperidin-1-ylhexyl)-1H-indazol-3-amine (PubChem CID 3021347) has the molecular formula C19H30N4 and a molecular weight of 314.48 g/mol. Its IUPAC name is N-(5-methyl-3-piperidin-1-ylhexyl)-1H-indazol-3-amine.

Molecular Properties

Compound NameN-(5-methyl-3-piperidin-1-ylhexyl)-1H-indazol-3-amine
PubChem CID3021347
Molecular FormulaC19H30N4
Molecular Weight314.48 g/mol
Exact Mass314.25
IUPAC NameN-(5-methyl-3-piperidin-1-ylhexyl)-1H-indazol-3-amine
SMILESCC(C)CC(CCNc1n[nH]c2ccccc12)N1CCCCC1
InChIInChI=1S/C19H30N4/c1-15(2)14-16(23-12-6-3-7-13-23)10-11-20-19-17-8-4-5-9-18(17)21-22-19/h4-5,8-9,15-16H,3,6-7,10-14H2,1-2H3,(H2,20,21,22)
InChIKeyXFXBHOVYUBIUIK-UHFFFAOYSA-N
XLogP4.27
TPSA43.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.48
LogP ≤ 54.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-Phenylazanyl-1,4,6,7-Tetrahydropyrazolo[4,3-C]pyridin-5-Yl)ethanone
CID 95828281
N-(1-isobutylpiperidin-3-yl)-1H-indazol-5-amine
CID 17838157
N-(1-Ethyl-4-piperidyl)-N-(1H-5-indazolyl)-amine
CID 17838238
N-(3-fluorophenyl)-1H-indazol-3-amine
CID 25096268
N-(1-Benzylpiperidin-3-yl)-3-methyl-2H-indazol-5-amine
CID 44421899
6-(3-Amino-1H-indazol-6-yl)-N4-(1-methylethyl)-2,4-pyrimidinediamine
CID 51356854
1-(3-(m-tolylamino)-6,7-dihydro-1H-pyrazolo[4,3-c]pyridin-5(4H)-yl)ethanone
CID 121365342
1-Phenethyl-4-(5-phenyl-1H-pyrazol-3-yl)-piperazine
CID 10735344
N-(1-(3,4-dimethylbenzyl)piperidin-4-yl)-5-chloro-1H-indazol-3-amine
CID 44405431
N-(1-(4-chlorobenzyl)piperidin-4-yl)-5-chloro-1H-indazol-3-amine
CID 44405459
N-(1-benzylpiperidin-4-yl)-5-chloro-1H-indazol-3-amine
CID 44405477
N-((1-benzylpiperidin-4-yl)methyl)-1H-indazol-3-amine
CID 46889747

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-3-piperidin-1-ylhexyl)-1H-indazol-3-amine?
The IUPAC name of N-(5-methyl-3-piperidin-1-ylhexyl)-1H-indazol-3-amine (CID 3021347) is N-(5-methyl-3-piperidin-1-ylhexyl)-1H-indazol-3-amine.
What is the SMILES notation for N-(5-methyl-3-piperidin-1-ylhexyl)-1H-indazol-3-amine?
The canonical SMILES for N-(5-methyl-3-piperidin-1-ylhexyl)-1H-indazol-3-amine is CC(C)CC(CCNc1n[nH]c2ccccc12)N1CCCCC1.
What is the InChIKey of N-(5-methyl-3-piperidin-1-ylhexyl)-1H-indazol-3-amine?
The InChIKey is XFXBHOVYUBIUIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N4/c1-15(2)14-16(23-12-6-3-7-13-23)10-11-20-19-17-8-4-5-9-18(17)21-22-19/h4-5,8-9,15-16H,3,6-7,10-14H2,1-2H3,(H2,20,21,22).
What are the key properties of N-(5-methyl-3-piperidin-1-ylhexyl)-1H-indazol-3-amine?
N-(5-methyl-3-piperidin-1-ylhexyl)-1H-indazol-3-amine has a molecular weight of 314.48 g/mol, XLogP of 4.27, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-3-piperidin-1-ylhexyl)-1H-indazol-3-amine is sourced from PubChem (CID 3021347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).