1-[2-(3-phenylpyrrolidin-1-yl)ethyl]pyrazol-4-amine

C15H20N4 — CID 62138451

IUPAC1-[2-(3-phenylpyrrolidin-1-yl)ethyl]pyrazol-4-amine
SMILESNc1cnn(CCN2CCC(c3ccccc3)C2)c1
InChIInChI=1S/C15H20N4/c16-15-10-17-19(12-15)9-8-18-7-6-14(11-18)13-4-2-1-3-5-13/h1-5,10,12,14H,6-9,11,16H2
InChIKeyLNZDGIIGCSZKRZ-UHFFFAOYSA-N
MW256.35 g/mol
LogP1.95
Rot. Bonds4

About 1-[2-(3-phenylpyrrolidin-1-yl)ethyl]pyrazol-4-amine

1-[2-(3-phenylpyrrolidin-1-yl)ethyl]pyrazol-4-amine (PubChem CID 62138451) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is 1-[2-(3-phenylpyrrolidin-1-yl)ethyl]pyrazol-4-amine.

Molecular Properties

Compound Name1-[2-(3-phenylpyrrolidin-1-yl)ethyl]pyrazol-4-amine
PubChem CID62138451
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC Name1-[2-(3-phenylpyrrolidin-1-yl)ethyl]pyrazol-4-amine
SMILESNc1cnn(CCN2CCC(c3ccccc3)C2)c1
InChIInChI=1S/C15H20N4/c16-15-10-17-19(12-15)9-8-18-7-6-14(11-18)13-4-2-1-3-5-13/h1-5,10,12,14H,6-9,11,16H2
InChIKeyLNZDGIIGCSZKRZ-UHFFFAOYSA-N
XLogP1.95
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]pyrazol-4-amine
CID 66392642
1-[2-(4-aminopyrazol-1-yl)ethyl]-3-phenylpyrrolidine-2,5-dione
CID 115319957
1-(2-chloroethyl)-3-phenylpyrrolidine
CID 62133780
5-[(3-phenylpyrrolidin-1-yl)methyl]-1,3-thiazol-2-amine
CID 79772023
1-(2-thiomorpholin-4-ylethyl)pyrazol-4-amine
CID 62137692
3-[(3S)-3-phenylpyrrolidin-1-yl]propanoic acid
CID 94362410
9-(3-phenylpyrrolidin-1-yl)nonane-1-thiol
CID 105343948
2,2-dimethyl-4-(3-phenylpyrrolidin-1-yl)butan-1-amine
CID 65247484
4-[(3S)-1-[2-(4-chloropyrazol-1-yl)ethyl]piperidin-3-yl]benzoic acid
CID 97206519
2,2-dimethyl-5-(3-phenylpyrrolidin-1-yl)pentan-1-amine
CID 65254158
2-methoxy-4-(3-phenylpyrrolidin-1-yl)butan-1-amine
CID 103152450
2-methyl-N-[2-(3-phenylpyrrolidin-1-yl)ethyl]propan-2-amine
CID 55069157

Frequently Asked Questions

What is the IUPAC name of 1-[2-(3-phenylpyrrolidin-1-yl)ethyl]pyrazol-4-amine?
The IUPAC name of 1-[2-(3-phenylpyrrolidin-1-yl)ethyl]pyrazol-4-amine (CID 62138451) is 1-[2-(3-phenylpyrrolidin-1-yl)ethyl]pyrazol-4-amine.
What is the SMILES notation for 1-[2-(3-phenylpyrrolidin-1-yl)ethyl]pyrazol-4-amine?
The canonical SMILES for 1-[2-(3-phenylpyrrolidin-1-yl)ethyl]pyrazol-4-amine is Nc1cnn(CCN2CCC(c3ccccc3)C2)c1.
What is the InChIKey of 1-[2-(3-phenylpyrrolidin-1-yl)ethyl]pyrazol-4-amine?
The InChIKey is LNZDGIIGCSZKRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c16-15-10-17-19(12-15)9-8-18-7-6-14(11-18)13-4-2-1-3-5-13/h1-5,10,12,14H,6-9,11,16H2.
What are the key properties of 1-[2-(3-phenylpyrrolidin-1-yl)ethyl]pyrazol-4-amine?
1-[2-(3-phenylpyrrolidin-1-yl)ethyl]pyrazol-4-amine has a molecular weight of 256.35 g/mol, XLogP of 1.95, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(3-phenylpyrrolidin-1-yl)ethyl]pyrazol-4-amine is sourced from PubChem (CID 62138451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).