N-(3-piperidin-1-ylpropyl)-1H-indazol-3-amine

C15H22N4 — CID 3068039

IUPACN-(3-piperidin-1-ylpropyl)-1H-indazol-3-amine
SMILESc1ccc2c(NCCCN3CCCCC3)n[nH]c2c1
InChIInChI=1S/C15H22N4/c1-4-10-19(11-5-1)12-6-9-16-15-13-7-2-3-8-14(13)17-18-15/h2-3,7-8H,1,4-6,9-12H2,(H2,16,17,18)
InChIKeyVNQGLEGVJDTWLQ-UHFFFAOYSA-N
MW258.37 g/mol
LogP2.85
Rot. Bonds5

About N-(3-piperidin-1-ylpropyl)-1H-indazol-3-amine

N-(3-piperidin-1-ylpropyl)-1H-indazol-3-amine (PubChem CID 3068039) has the molecular formula C15H22N4 and a molecular weight of 258.37 g/mol. Its IUPAC name is N-(3-piperidin-1-ylpropyl)-1H-indazol-3-amine.

Molecular Properties

Compound NameN-(3-piperidin-1-ylpropyl)-1H-indazol-3-amine
PubChem CID3068039
Molecular FormulaC15H22N4
Molecular Weight258.37 g/mol
Exact Mass258.18
IUPAC NameN-(3-piperidin-1-ylpropyl)-1H-indazol-3-amine
SMILESc1ccc2c(NCCCN3CCCCC3)n[nH]c2c1
InChIInChI=1S/C15H22N4/c1-4-10-19(11-5-1)12-6-9-16-15-13-7-2-3-8-14(13)17-18-15/h2-3,7-8H,1,4-6,9-12H2,(H2,16,17,18)
InChIKeyVNQGLEGVJDTWLQ-UHFFFAOYSA-N
XLogP2.85
TPSA43.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.37
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-(3-Amino-2h-Indazol-6-Yl)-N~4~-Ethylpyrimidine-2,4-Diamine
CID 46214652
1-(3-Phenylazanyl-1,4,6,7-Tetrahydropyrazolo[4,3-C]pyridin-5-Yl)ethanone
CID 95828281
N-(3-fluorophenyl)-1H-indazol-3-amine
CID 25096268
N-(3-chlorophenyl)-1H-indazol-3-amine
CID 25096270
6-(3-Amino-1H-indazol-6-yl)-N4-isopropylpyrimidine-2,4-diamine
CID 51356854
1-(3-(m-tolylamino)-6,7-dihydro-1H-pyrazolo[4,3-c]pyridin-5(4H)-yl)ethanone
CID 121365342
N-methyl-5-phenyl-1H-pyrazol-3-amine
CID 12356179
1-(5-phenyl-1H-pyrazol-3-yl)azepane
CID 973199
1-Phenethyl-4-(5-phenyl-1H-pyrazol-3-yl)-piperazine
CID 10735344
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-(3-piperidin-1-ylpropyl)-1H-indazol-3-amine?
The IUPAC name of N-(3-piperidin-1-ylpropyl)-1H-indazol-3-amine (CID 3068039) is N-(3-piperidin-1-ylpropyl)-1H-indazol-3-amine.
What is the SMILES notation for N-(3-piperidin-1-ylpropyl)-1H-indazol-3-amine?
The canonical SMILES for N-(3-piperidin-1-ylpropyl)-1H-indazol-3-amine is c1ccc2c(NCCCN3CCCCC3)n[nH]c2c1.
What is the InChIKey of N-(3-piperidin-1-ylpropyl)-1H-indazol-3-amine?
The InChIKey is VNQGLEGVJDTWLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4/c1-4-10-19(11-5-1)12-6-9-16-15-13-7-2-3-8-14(13)17-18-15/h2-3,7-8H,1,4-6,9-12H2,(H2,16,17,18).
What are the key properties of N-(3-piperidin-1-ylpropyl)-1H-indazol-3-amine?
N-(3-piperidin-1-ylpropyl)-1H-indazol-3-amine has a molecular weight of 258.37 g/mol, XLogP of 2.85, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-piperidin-1-ylpropyl)-1H-indazol-3-amine is sourced from PubChem (CID 3068039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).