4-[5-[1-(3-phenylpropyl)pyrrolidin-2-yl]-1H-pyrazol-4-yl]pyridin-2-amine

C21H25N5 — CID 110254366

IUPAC4-[5-[1-(3-phenylpropyl)pyrrolidin-2-yl]-1H-pyrazol-4-yl]pyridin-2-amine
SMILESNc1cc(-c2cn[nH]c2C2CCCN2CCCc2ccccc2)ccn1
InChIInChI=1S/C21H25N5/c22-20-14-17(10-11-23-20)18-15-24-25-21(18)19-9-5-13-26(19)12-4-8-16-6-2-1-3-7-16/h1-3,6-7,10-11,14-15,19H,4-5,8-9,12-13H2,(H2,22,23)(H,24,25)
InChIKeyXUXAJUOYYBJWRM-UHFFFAOYSA-N
MW347.47 g/mol
LogP3.82
Rot. Bonds6

About 4-[5-[1-(3-phenylpropyl)pyrrolidin-2-yl]-1H-pyrazol-4-yl]pyridin-2-amine

4-[5-[1-(3-phenylpropyl)pyrrolidin-2-yl]-1H-pyrazol-4-yl]pyridin-2-amine (PubChem CID 110254366) has the molecular formula C21H25N5 and a molecular weight of 347.47 g/mol. Its IUPAC name is 4-[5-[1-(3-phenylpropyl)pyrrolidin-2-yl]-1H-pyrazol-4-yl]pyridin-2-amine.

Molecular Properties

Compound Name4-[5-[1-(3-phenylpropyl)pyrrolidin-2-yl]-1H-pyrazol-4-yl]pyridin-2-amine
PubChem CID110254366
Molecular FormulaC21H25N5
Molecular Weight347.47 g/mol
Exact Mass347.21
IUPAC Name4-[5-[1-(3-phenylpropyl)pyrrolidin-2-yl]-1H-pyrazol-4-yl]pyridin-2-amine
SMILESNc1cc(-c2cn[nH]c2C2CCCN2CCCc2ccccc2)ccn1
InChIInChI=1S/C21H25N5/c22-20-14-17(10-11-23-20)18-15-24-25-21(18)19-9-5-13-26(19)12-4-8-16-6-2-1-3-7-16/h1-3,6-7,10-11,14-15,19H,4-5,8-9,12-13H2,(H2,22,23)(H,24,25)
InChIKeyXUXAJUOYYBJWRM-UHFFFAOYSA-N
XLogP3.82
TPSA70.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.47
LogP ≤ 53.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-[5-[1-(3-phenylpropyl)pyrrolidin-2-yl]-1H-pyrazol-4-yl]pyridin-2-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

4-[3-(4-fluorophenyl)-1H-pyrazol-4-yl]pyridine
CID 12106168
GW-6604
CID 9861063
5-Pyridin-3-yl-2H-pyrazol-3-ylamine
CID 7446899
2-(4-fluorophenyl)-4-(3-(pyridin-2-yl)-1H-pyrazol-4-yl)pyridine
CID 9858084
2-(4-Isopropylphenyl)-4-(3-(pyridin-2-yl)-1H-pyrazol-4-yl)pyridine
CID 11717091
Pyrazole 79
CID 23647348
Isopropyl-[6-piperazin-1-yl-4-(1H-pyrazol-4-yl)[2,4'']bipyridinyl-2''-yl]amine
CID 46899553
N-(oxan-4-yl)-4-[6-piperazin-1-yl-4-(1H-pyrazol-4-yl)-2-pyridinyl]pyridin-2-amine
CID 46899554
Cyclohexyl-[6-piperazin-1-yl-4-(1H-pyrazol-4-yl)[2,4'']bipyridinyl-2''-yl]amine
CID 46902013
3-methyl-4-[2-[(3-phenyl-1H-pyrazol-5-yl)methylamino]-4-pyridinyl]benzonitrile
CID 66559551
(3S)-1-[3-methyl-6-[5-(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-c]pyridin-3-yl]-2-pyridinyl]piperidin-3-amine
CID 71253383
5-(1-ethylpyrazol-4-yl)-3-(6-piperazin-1-yl-2-pyridinyl)-1H-pyrazolo[3,4-c]pyridine
CID 71253671

Frequently Asked Questions

What is the IUPAC name of 4-[5-[1-(3-phenylpropyl)pyrrolidin-2-yl]-1H-pyrazol-4-yl]pyridin-2-amine?
The IUPAC name of 4-[5-[1-(3-phenylpropyl)pyrrolidin-2-yl]-1H-pyrazol-4-yl]pyridin-2-amine (CID 110254366) is 4-[5-[1-(3-phenylpropyl)pyrrolidin-2-yl]-1H-pyrazol-4-yl]pyridin-2-amine.
What is the SMILES notation for 4-[5-[1-(3-phenylpropyl)pyrrolidin-2-yl]-1H-pyrazol-4-yl]pyridin-2-amine?
The canonical SMILES for 4-[5-[1-(3-phenylpropyl)pyrrolidin-2-yl]-1H-pyrazol-4-yl]pyridin-2-amine is Nc1cc(-c2cn[nH]c2C2CCCN2CCCc2ccccc2)ccn1.
What is the InChIKey of 4-[5-[1-(3-phenylpropyl)pyrrolidin-2-yl]-1H-pyrazol-4-yl]pyridin-2-amine?
The InChIKey is XUXAJUOYYBJWRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N5/c22-20-14-17(10-11-23-20)18-15-24-25-21(18)19-9-5-13-26(19)12-4-8-16-6-2-1-3-7-16/h1-3,6-7,10-11,14-15,19H,4-5,8-9,12-13H2,(H2,22,23)(H,24,25).
What are the key properties of 4-[5-[1-(3-phenylpropyl)pyrrolidin-2-yl]-1H-pyrazol-4-yl]pyridin-2-amine?
4-[5-[1-(3-phenylpropyl)pyrrolidin-2-yl]-1H-pyrazol-4-yl]pyridin-2-amine has a molecular weight of 347.47 g/mol, XLogP of 3.82, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-[1-(3-phenylpropyl)pyrrolidin-2-yl]-1H-pyrazol-4-yl]pyridin-2-amine is sourced from PubChem (CID 110254366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).