4-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)benzamide

C16H20N2OS — CID 62177548

IUPAC4-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)benzamide
SMILESCCNc1ccc(C(=O)NC(C)Cc2ccsc2)cc1
InChIInChI=1S/C16H20N2OS/c1-3-17-15-6-4-14(5-7-15)16(19)18-12(2)10-13-8-9-20-11-13/h4-9,11-12,17H,3,10H2,1-2H3,(H,18,19)
InChIKeyRBKNLVCYLSNCNE-UHFFFAOYSA-N
MW288.42 g/mol
LogP3.54
Rot. Bonds6

About 4-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)benzamide

4-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)benzamide (PubChem CID 62177548) has the molecular formula C16H20N2OS and a molecular weight of 288.42 g/mol. Its IUPAC name is 4-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)benzamide.

Molecular Properties

Compound Name4-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)benzamide
PubChem CID62177548
Molecular FormulaC16H20N2OS
Molecular Weight288.42 g/mol
Exact Mass288.13
IUPAC Name4-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)benzamide
SMILESCCNc1ccc(C(=O)NC(C)Cc2ccsc2)cc1
InChIInChI=1S/C16H20N2OS/c1-3-17-15-6-4-14(5-7-15)16(19)18-12(2)10-13-8-9-20-11-13/h4-9,11-12,17H,3,10H2,1-2H3,(H,18,19)
InChIKeyRBKNLVCYLSNCNE-UHFFFAOYSA-N
XLogP3.54
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.42
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-N-cyclopropyl-4-N-(1-thiophen-3-ylpropan-2-yl)benzene-1,4-dicarboxamide
CID 75390351
4-(ethylamino)-N-(2-thiophen-3-ylethyl)benzamide
CID 62173994
2,6-dichloro-N-(1-thiophen-3-ylpropan-2-yl)pyridine-4-carboxamide
CID 61150801
N-[(2S)-1-thiophen-3-ylpropan-2-yl]-2H-benzotriazole-5-carboxamide
CID 94194343
3-amino-4-ethoxy-N-(1-thiophen-3-ylpropan-2-yl)benzamide
CID 61471915
3-(chloromethyl)-N-(1-thiophen-3-ylpropan-2-yl)benzamide
CID 61473727
2-amino-2-methyl-N-(1-thiophen-3-ylpropan-2-yl)butanamide
CID 79805381
3-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)butanamide
CID 62831629
6-(1-thiophen-3-ylpropan-2-ylcarbamoyl)pyridine-3-carboxylic acid
CID 61151193
5-bromo-2-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-carboxamide
CID 62176839
2-[(4-tert-butylbenzoyl)amino]-3-thiophen-3-ylpropanoic acid
CID 163988488
2-(1-thiophen-3-ylpropan-2-ylcarbamoyl)benzoic acid
CID 61475052

Frequently Asked Questions

What is the IUPAC name of 4-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)benzamide?
The IUPAC name of 4-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)benzamide (CID 62177548) is 4-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)benzamide.
What is the SMILES notation for 4-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)benzamide?
The canonical SMILES for 4-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)benzamide is CCNc1ccc(C(=O)NC(C)Cc2ccsc2)cc1.
What is the InChIKey of 4-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)benzamide?
The InChIKey is RBKNLVCYLSNCNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2OS/c1-3-17-15-6-4-14(5-7-15)16(19)18-12(2)10-13-8-9-20-11-13/h4-9,11-12,17H,3,10H2,1-2H3,(H,18,19).
What are the key properties of 4-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)benzamide?
4-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)benzamide has a molecular weight of 288.42 g/mol, XLogP of 3.54, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)benzamide is sourced from PubChem (CID 62177548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).