5-(4-hydroxyphenyl)-N-[(1-phenylcyclopentyl)methyl]pyrazolidine-3-carboxamide

C22H27N3O2 — CID 134081161

IUPAC5-(4-hydroxyphenyl)-N-[(1-phenylcyclopentyl)methyl]pyrazolidine-3-carboxamide
SMILESO=C(NCC1(c2ccccc2)CCCC1)C1CC(c2ccc(O)cc2)NN1
InChIInChI=1S/C22H27N3O2/c26-18-10-8-16(9-11-18)19-14-20(25-24-19)21(27)23-15-22(12-4-5-13-22)17-6-2-1-3-7-17/h1-3,6-11,19-20,24-26H,4-5,12-15H2,(H,23,27)
InChIKeyBXDHQYRHMDVHEH-UHFFFAOYSA-N
MW365.48 g/mol
LogP2.93
Rot. Bonds5

About 5-(4-hydroxyphenyl)-N-[(1-phenylcyclopentyl)methyl]pyrazolidine-3-carboxamide

5-(4-hydroxyphenyl)-N-[(1-phenylcyclopentyl)methyl]pyrazolidine-3-carboxamide (PubChem CID 134081161) has the molecular formula C22H27N3O2 and a molecular weight of 365.48 g/mol. Its IUPAC name is 5-(4-hydroxyphenyl)-N-[(1-phenylcyclopentyl)methyl]pyrazolidine-3-carboxamide.

Molecular Properties

Compound Name5-(4-hydroxyphenyl)-N-[(1-phenylcyclopentyl)methyl]pyrazolidine-3-carboxamide
PubChem CID134081161
Molecular FormulaC22H27N3O2
Molecular Weight365.48 g/mol
Exact Mass365.21
IUPAC Name5-(4-hydroxyphenyl)-N-[(1-phenylcyclopentyl)methyl]pyrazolidine-3-carboxamide
SMILESO=C(NCC1(c2ccccc2)CCCC1)C1CC(c2ccc(O)cc2)NN1
InChIInChI=1S/C22H27N3O2/c26-18-10-8-16(9-11-18)19-14-20(25-24-19)21(27)23-15-22(12-4-5-13-22)17-6-2-1-3-7-17/h1-3,6-11,19-20,24-26H,4-5,12-15H2,(H,23,27)
InChIKeyBXDHQYRHMDVHEH-UHFFFAOYSA-N
XLogP2.93
TPSA73.39 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.48
LogP ≤ 52.93
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1-phenylcyclopentyl)methyl]pyrrolidine-2-carboxamide
CID 110481276
(3R)-1,1-dioxo-N-[(1-phenylcyclopentyl)methyl]-3,4-dihydro-2H-1λ6,2-benzothiazine-3-carboxamide
CID 99972048
N-[(1-phenylcyclopentyl)methyl]cyclohexanecarboxamide
CID 18128273
5-(4-hydroxyphenyl)-N-[2-(4-phenylpiperidin-1-yl)ethyl]pyrazolidine-3-carboxamide
CID 134080957
N-[(1-phenylcyclopentyl)methyl]piperidine-4-carboxamide
CID 119275845
3-amino-N-[(1-phenylcyclopentyl)methyl]cyclopentane-1-carboxamide
CID 119698154
3-amino-N-[(1-phenylcyclopentyl)methyl]bicyclo[2.2.1]heptane-2-carboxamide;hydrochloride
CID 119698155
5-(4-hydroxyphenyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazolidine-3-carboxamide
CID 134080246
N-[(1-phenylcyclohexyl)methyl]oxane-4-carboxamide
CID 51078296
(1S,3R,4R)-3-amino-4-hydroxy-N-[(1-phenylcyclohexyl)methyl]cyclopentane-1-carboxamide;hydrochloride
CID 155940030
1-amino-N-[(1-phenylcyclobutyl)methyl]cyclopentane-1-carboxamide;hydrochloride
CID 119276343
(3S)-N-[(1-phenylcyclopentyl)methyl]oxolane-3-carboxamide
CID 95272452

Frequently Asked Questions

What is the IUPAC name of 5-(4-hydroxyphenyl)-N-[(1-phenylcyclopentyl)methyl]pyrazolidine-3-carboxamide?
The IUPAC name of 5-(4-hydroxyphenyl)-N-[(1-phenylcyclopentyl)methyl]pyrazolidine-3-carboxamide (CID 134081161) is 5-(4-hydroxyphenyl)-N-[(1-phenylcyclopentyl)methyl]pyrazolidine-3-carboxamide.
What is the SMILES notation for 5-(4-hydroxyphenyl)-N-[(1-phenylcyclopentyl)methyl]pyrazolidine-3-carboxamide?
The canonical SMILES for 5-(4-hydroxyphenyl)-N-[(1-phenylcyclopentyl)methyl]pyrazolidine-3-carboxamide is O=C(NCC1(c2ccccc2)CCCC1)C1CC(c2ccc(O)cc2)NN1.
What is the InChIKey of 5-(4-hydroxyphenyl)-N-[(1-phenylcyclopentyl)methyl]pyrazolidine-3-carboxamide?
The InChIKey is BXDHQYRHMDVHEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27N3O2/c26-18-10-8-16(9-11-18)19-14-20(25-24-19)21(27)23-15-22(12-4-5-13-22)17-6-2-1-3-7-17/h1-3,6-11,19-20,24-26H,4-5,12-15H2,(H,23,27).
What are the key properties of 5-(4-hydroxyphenyl)-N-[(1-phenylcyclopentyl)methyl]pyrazolidine-3-carboxamide?
5-(4-hydroxyphenyl)-N-[(1-phenylcyclopentyl)methyl]pyrazolidine-3-carboxamide has a molecular weight of 365.48 g/mol, XLogP of 2.93, 5 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-hydroxyphenyl)-N-[(1-phenylcyclopentyl)methyl]pyrazolidine-3-carboxamide is sourced from PubChem (CID 134081161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).