(4R)-N-(5,6-dihydro-4H-cyclopenta[c]thiophen-4-yl)-4-(dimethylamino)-5-(4-hydroxyphenyl)pentanamide

C20H26N2O2S — CID 139362877

IUPAC(4R)-N-(5,6-dihydro-4H-cyclopenta[c]thiophen-4-yl)-4-(dimethylamino)-5-(4-hydroxyphenyl)pentanamide
SMILESCN(C)[C@H](CCC(=O)NC1CCc2cscc21)Cc1ccc(O)cc1
InChIInChI=1S/C20H26N2O2S/c1-22(2)16(11-14-3-7-17(23)8-4-14)6-10-20(24)21-19-9-5-15-12-25-13-18(15)19/h3-4,7-8,12-13,16,19,23H,5-6,9-11H2,1-2H3,(H,21,24)/t16-,19?/m1/s1
InChIKeyAZXVJBKLAJHOKK-VTBWFHPJSA-N
MW358.51 g/mol
LogP3.51
Rot. Bonds7

About (4R)-N-(5,6-dihydro-4H-cyclopenta[c]thiophen-4-yl)-4-(dimethylamino)-5-(4-hydroxyphenyl)pentanamide

(4R)-N-(5,6-dihydro-4H-cyclopenta[c]thiophen-4-yl)-4-(dimethylamino)-5-(4-hydroxyphenyl)pentanamide (PubChem CID 139362877) has the molecular formula C20H26N2O2S and a molecular weight of 358.51 g/mol. Its IUPAC name is (4R)-N-(5,6-dihydro-4H-cyclopenta[c]thiophen-4-yl)-4-(dimethylamino)-5-(4-hydroxyphenyl)pentanamide.

Molecular Properties

Compound Name(4R)-N-(5,6-dihydro-4H-cyclopenta[c]thiophen-4-yl)-4-(dimethylamino)-5-(4-hydroxyphenyl)pentanamide
PubChem CID139362877
Molecular FormulaC20H26N2O2S
Molecular Weight358.51 g/mol
Exact Mass358.17
IUPAC Name(4R)-N-(5,6-dihydro-4H-cyclopenta[c]thiophen-4-yl)-4-(dimethylamino)-5-(4-hydroxyphenyl)pentanamide
SMILESCN(C)[C@H](CCC(=O)NC1CCc2cscc21)Cc1ccc(O)cc1
InChIInChI=1S/C20H26N2O2S/c1-22(2)16(11-14-3-7-17(23)8-4-14)6-10-20(24)21-19-9-5-15-12-25-13-18(15)19/h3-4,7-8,12-13,16,19,23H,5-6,9-11H2,1-2H3,(H,21,24)/t16-,19?/m1/s1
InChIKeyAZXVJBKLAJHOKK-VTBWFHPJSA-N
XLogP3.51
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.51
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze (4R)-N-(5,6-dihydro-4H-cyclopenta[c]thiophen-4-yl)-4-(dimethylamino)-5-(4-hydroxyphenyl)pentanamide 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

(4R)-N-[(1R)-2,3-dihydro-1H-inden-1-yl]-4-(dimethylamino)-5-(4-hydroxyphenyl)pentanamide
CID 153328550
(4R)-4-(dimethylamino)-5-(4-hydroxyphenyl)-N-(3-methyl-5,6-dihydro-4H-cyclopenta[b]thiophen-6-yl)pentanamide
CID 139363022
(4R)-4-(dimethylamino)-5-(4-hydroxyphenyl)-N-(4-hydroxy-1,2,3,4-tetrahydronaphthalen-1-yl)pentanamide
CID 139362916
(4R)-N-(2,3-dihydro-1-benzothiophen-3-yl)-4-(dimethylamino)-5-(4-hydroxyphenyl)pentanamide
CID 139362872
(4R)-4-(dimethylamino)-5-(4-hydroxyphenyl)-N-(3-oxo-1,2-dihydroinden-1-yl)pentanamide
CID 139362871
(4R)-N-(6-bromo-1,1-dioxo-3,4-dihydro-2H-thiochromen-4-yl)-4-(dimethylamino)-5-(4-hydroxyphenyl)pentanamide
CID 139362973
N-(2,3-dihydro-1H-inden-1-yl)-4-(2,3-dihydro-1H-inden-1-ylamino)-4-hydroxybutanamide
CID 134345086
3-(5-hydroxypentan-2-yl)-1-[1-(4-hydroxyphenyl)propan-2-yl]-1-methylurea
CID 109390126
N-(2,6-dioxopiperidin-3-yl)-3-(4-hydroxyphenyl)propanamide
CID 110483854
(2S)-2-(dimethylamino)-3-(4-hydroxyphenyl)propanamide
CID 70366423
N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]-2-thiophen-3-ylacetamide
CID 7688469
3-[1-(4-hydroxyphenyl)propan-2-ylamino]-1-methylpiperidine-2,6-dione
CID 115494415

Frequently Asked Questions

What is the IUPAC name of (4R)-N-(5,6-dihydro-4H-cyclopenta[c]thiophen-4-yl)-4-(dimethylamino)-5-(4-hydroxyphenyl)pentanamide?
The IUPAC name of (4R)-N-(5,6-dihydro-4H-cyclopenta[c]thiophen-4-yl)-4-(dimethylamino)-5-(4-hydroxyphenyl)pentanamide (CID 139362877) is (4R)-N-(5,6-dihydro-4H-cyclopenta[c]thiophen-4-yl)-4-(dimethylamino)-5-(4-hydroxyphenyl)pentanamide.
What is the SMILES notation for (4R)-N-(5,6-dihydro-4H-cyclopenta[c]thiophen-4-yl)-4-(dimethylamino)-5-(4-hydroxyphenyl)pentanamide?
The canonical SMILES for (4R)-N-(5,6-dihydro-4H-cyclopenta[c]thiophen-4-yl)-4-(dimethylamino)-5-(4-hydroxyphenyl)pentanamide is CN(C)[C@H](CCC(=O)NC1CCc2cscc21)Cc1ccc(O)cc1.
What is the InChIKey of (4R)-N-(5,6-dihydro-4H-cyclopenta[c]thiophen-4-yl)-4-(dimethylamino)-5-(4-hydroxyphenyl)pentanamide?
The InChIKey is AZXVJBKLAJHOKK-VTBWFHPJSA-N. The full InChI is InChI=1S/C20H26N2O2S/c1-22(2)16(11-14-3-7-17(23)8-4-14)6-10-20(24)21-19-9-5-15-12-25-13-18(15)19/h3-4,7-8,12-13,16,19,23H,5-6,9-11H2,1-2H3,(H,21,24)/t16-,19?/m1/s1.
What are the key properties of (4R)-N-(5,6-dihydro-4H-cyclopenta[c]thiophen-4-yl)-4-(dimethylamino)-5-(4-hydroxyphenyl)pentanamide?
(4R)-N-(5,6-dihydro-4H-cyclopenta[c]thiophen-4-yl)-4-(dimethylamino)-5-(4-hydroxyphenyl)pentanamide has a molecular weight of 358.51 g/mol, XLogP of 3.51, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-N-(5,6-dihydro-4H-cyclopenta[c]thiophen-4-yl)-4-(dimethylamino)-5-(4-hydroxyphenyl)pentanamide is sourced from PubChem (CID 139362877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).