5-(4-hydroxyphenyl)-N-[2-(4-phenylpiperidin-1-yl)ethyl]pyrazolidine-3-carboxamide

C23H30N4O2 — CID 134080957

IUPAC5-(4-hydroxyphenyl)-N-[2-(4-phenylpiperidin-1-yl)ethyl]pyrazolidine-3-carboxamide
SMILESO=C(NCCN1CCC(c2ccccc2)CC1)C1CC(c2ccc(O)cc2)NN1
InChIInChI=1S/C23H30N4O2/c28-20-8-6-19(7-9-20)21-16-22(26-25-21)23(29)24-12-15-27-13-10-18(11-14-27)17-4-2-1-3-5-17/h1-9,18,21-22,25-26,28H,10-16H2,(H,24,29)
InChIKeyZJQXEVHUECBFRA-UHFFFAOYSA-N
MW394.52 g/mol
LogP2.30
Rot. Bonds6

About 5-(4-hydroxyphenyl)-N-[2-(4-phenylpiperidin-1-yl)ethyl]pyrazolidine-3-carboxamide

5-(4-hydroxyphenyl)-N-[2-(4-phenylpiperidin-1-yl)ethyl]pyrazolidine-3-carboxamide (PubChem CID 134080957) has the molecular formula C23H30N4O2 and a molecular weight of 394.52 g/mol. Its IUPAC name is 5-(4-hydroxyphenyl)-N-[2-(4-phenylpiperidin-1-yl)ethyl]pyrazolidine-3-carboxamide.

Molecular Properties

Compound Name5-(4-hydroxyphenyl)-N-[2-(4-phenylpiperidin-1-yl)ethyl]pyrazolidine-3-carboxamide
PubChem CID134080957
Molecular FormulaC23H30N4O2
Molecular Weight394.52 g/mol
Exact Mass394.24
IUPAC Name5-(4-hydroxyphenyl)-N-[2-(4-phenylpiperidin-1-yl)ethyl]pyrazolidine-3-carboxamide
SMILESO=C(NCCN1CCC(c2ccccc2)CC1)C1CC(c2ccc(O)cc2)NN1
InChIInChI=1S/C23H30N4O2/c28-20-8-6-19(7-9-20)21-16-22(26-25-21)23(29)24-12-15-27-13-10-18(11-14-27)17-4-2-1-3-5-17/h1-9,18,21-22,25-26,28H,10-16H2,(H,24,29)
InChIKeyZJQXEVHUECBFRA-UHFFFAOYSA-N
XLogP2.30
TPSA76.63 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.52
LogP ≤ 52.30
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-morpholin-4-ylethyl)-5-phenylpyrazolidine-3-carboxamide
CID 74653698
1-[2-[[5-(4-hydroxyphenyl)pyrazolidine-3-carbonyl]amino]ethyl]piperidine-3-carboxamide
CID 134080643
N-[2-(2-oxoazepan-1-yl)ethyl]-5-phenylpyrazolidine-3-carboxamide
CID 52989414
5-phenyl-N-(3-pyrrol-1-ylpropyl)pyrazolidine-3-carboxamide
CID 75272192
N-[2-[4-(3-methoxy-1-methylpyrazole-4-carbonyl)piperazin-1-yl]ethyl]-5-phenylpyrazolidine-3-carboxamide
CID 75355259
N-ethyl-5-phenylpyrazolidine-3-carboxamide
CID 73487890
(2R)-N-[2-(4-phenylpiperidin-1-yl)ethyl]oxane-2-carboxamide
CID 125157377
N-(3-butoxypropyl)-5-phenylpyrazolidine-3-carboxamide
CID 74537316
4-[2-(4-phenylpiperidin-1-yl)ethylcarbamoyl]benzoic acid
CID 74239784
5-(4-hydroxyphenyl)-N-[(1-phenylcyclopentyl)methyl]pyrazolidine-3-carboxamide
CID 134081161
5-(4-hydroxyphenyl)-N-[2-(pyridin-3-ylamino)ethyl]pyrazolidine-3-carboxamide
CID 134077005
4-[2-(4-phenylpiperidin-1-yl)ethyl]phenol
CID 14819324

Frequently Asked Questions

What is the IUPAC name of 5-(4-hydroxyphenyl)-N-[2-(4-phenylpiperidin-1-yl)ethyl]pyrazolidine-3-carboxamide?
The IUPAC name of 5-(4-hydroxyphenyl)-N-[2-(4-phenylpiperidin-1-yl)ethyl]pyrazolidine-3-carboxamide (CID 134080957) is 5-(4-hydroxyphenyl)-N-[2-(4-phenylpiperidin-1-yl)ethyl]pyrazolidine-3-carboxamide.
What is the SMILES notation for 5-(4-hydroxyphenyl)-N-[2-(4-phenylpiperidin-1-yl)ethyl]pyrazolidine-3-carboxamide?
The canonical SMILES for 5-(4-hydroxyphenyl)-N-[2-(4-phenylpiperidin-1-yl)ethyl]pyrazolidine-3-carboxamide is O=C(NCCN1CCC(c2ccccc2)CC1)C1CC(c2ccc(O)cc2)NN1.
What is the InChIKey of 5-(4-hydroxyphenyl)-N-[2-(4-phenylpiperidin-1-yl)ethyl]pyrazolidine-3-carboxamide?
The InChIKey is ZJQXEVHUECBFRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N4O2/c28-20-8-6-19(7-9-20)21-16-22(26-25-21)23(29)24-12-15-27-13-10-18(11-14-27)17-4-2-1-3-5-17/h1-9,18,21-22,25-26,28H,10-16H2,(H,24,29).
What are the key properties of 5-(4-hydroxyphenyl)-N-[2-(4-phenylpiperidin-1-yl)ethyl]pyrazolidine-3-carboxamide?
5-(4-hydroxyphenyl)-N-[2-(4-phenylpiperidin-1-yl)ethyl]pyrazolidine-3-carboxamide has a molecular weight of 394.52 g/mol, XLogP of 2.30, 6 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-hydroxyphenyl)-N-[2-(4-phenylpiperidin-1-yl)ethyl]pyrazolidine-3-carboxamide is sourced from PubChem (CID 134080957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).