N-[1-(2-phenylethyl)piperidin-4-yl]-1H-indazol-5-amine

C20H24N4 — CID 14467953

IUPACN-[1-(2-phenylethyl)piperidin-4-yl]-1H-indazol-5-amine
SMILESc1ccc(CCN2CCC(Nc3ccc4[nH]ncc4c3)CC2)cc1
InChIInChI=1S/C20H24N4/c1-2-4-16(5-3-1)8-11-24-12-9-18(10-13-24)22-19-6-7-20-17(14-19)15-21-23-20/h1-7,14-15,18,22H,8-13H2,(H,21,23)
InChIKeyMCYVKDVSGUBCBD-UHFFFAOYSA-N
MW320.44 g/mol
LogP3.68
Rot. Bonds5

About N-[1-(2-phenylethyl)piperidin-4-yl]-1H-indazol-5-amine

N-[1-(2-phenylethyl)piperidin-4-yl]-1H-indazol-5-amine (PubChem CID 14467953) has the molecular formula C20H24N4 and a molecular weight of 320.44 g/mol. Its IUPAC name is N-[1-(2-phenylethyl)piperidin-4-yl]-1H-indazol-5-amine.

Molecular Properties

Compound NameN-[1-(2-phenylethyl)piperidin-4-yl]-1H-indazol-5-amine
PubChem CID14467953
Molecular FormulaC20H24N4
Molecular Weight320.44 g/mol
Exact Mass320.20
IUPAC NameN-[1-(2-phenylethyl)piperidin-4-yl]-1H-indazol-5-amine
SMILESc1ccc(CCN2CCC(Nc3ccc4[nH]ncc4c3)CC2)cc1
InChIInChI=1S/C20H24N4/c1-2-4-16(5-3-1)8-11-24-12-9-18(10-13-24)22-19-6-7-20-17(14-19)15-21-23-20/h1-7,14-15,18,22H,8-13H2,(H,21,23)
InChIKeyMCYVKDVSGUBCBD-UHFFFAOYSA-N
XLogP3.68
TPSA43.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.44
LogP ≤ 53.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[1-(2-phenylethyl)piperidin-4-yl]-1H-indazol-5-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-phenylethyl)-N-(1H-pyrazol-4-yl)piperidin-4-amine
CID 60797118
N-[(3R)-1-[(4-methylphenyl)methyl]pyrrolidin-3-yl]-1H-indazol-5-amine
CID 58022546
N-[1-[(3,4-dichlorophenyl)methyl]pyrrolidin-3-yl]-1H-indazol-5-amine
CID 57446054
N-[1-(2-phenylethyl)piperidin-4-yl]-1H-indazol-4-amine
CID 18447335
N-(1-methylpyrrolidin-3-yl)-1H-indazol-5-amine
CID 62976152
N-[(3R)-1-[(4-methoxyphenyl)methyl]pyrrolidin-3-yl]-1H-indazol-5-amine
CID 58022540
N-[1-[(3,5-dimethoxyphenyl)methyl]piperidin-4-yl]-1H-indazol-5-amine
CID 21098476
N-[(3R)-1-[(3-methylphenyl)methyl]piperidin-3-yl]-1H-indazol-5-amine
CID 58022538
N-[1-[[3-(methylsulfonylmethyl)phenyl]methyl]piperidin-3-yl]-1H-indazol-5-amine
CID 25009015
N-[(3S)-1-[(4-chlorophenyl)methyl]piperidin-3-yl]-1H-indazol-5-amine
CID 44599070
N-[(3R)-1-[(3-ethynylphenyl)methyl]piperidin-3-yl]-1H-indazol-5-amine
CID 44599558
N-(4-nitrophenyl)-1-(2-phenylethyl)piperidin-4-amine
CID 12741863

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-phenylethyl)piperidin-4-yl]-1H-indazol-5-amine?
The IUPAC name of N-[1-(2-phenylethyl)piperidin-4-yl]-1H-indazol-5-amine (CID 14467953) is N-[1-(2-phenylethyl)piperidin-4-yl]-1H-indazol-5-amine.
What is the SMILES notation for N-[1-(2-phenylethyl)piperidin-4-yl]-1H-indazol-5-amine?
The canonical SMILES for N-[1-(2-phenylethyl)piperidin-4-yl]-1H-indazol-5-amine is c1ccc(CCN2CCC(Nc3ccc4[nH]ncc4c3)CC2)cc1.
What is the InChIKey of N-[1-(2-phenylethyl)piperidin-4-yl]-1H-indazol-5-amine?
The InChIKey is MCYVKDVSGUBCBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4/c1-2-4-16(5-3-1)8-11-24-12-9-18(10-13-24)22-19-6-7-20-17(14-19)15-21-23-20/h1-7,14-15,18,22H,8-13H2,(H,21,23).
What are the key properties of N-[1-(2-phenylethyl)piperidin-4-yl]-1H-indazol-5-amine?
N-[1-(2-phenylethyl)piperidin-4-yl]-1H-indazol-5-amine has a molecular weight of 320.44 g/mol, XLogP of 3.68, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-phenylethyl)piperidin-4-yl]-1H-indazol-5-amine is sourced from PubChem (CID 14467953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).