N-tert-butyl-2-[[2-oxo-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]ethyl]amino]benzamide

C19H28N4O3 — CID 47077618

IUPACN-tert-butyl-2-[[2-oxo-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]ethyl]amino]benzamide
SMILESCC(C)(C)NC(=O)c1ccccc1NCC(=O)NCC(=O)N1CCCC1
InChIInChI=1S/C19H28N4O3/c1-19(2,3)22-18(26)14-8-4-5-9-15(14)20-12-16(24)21-13-17(25)23-10-6-7-11-23/h4-5,8-9,20H,6-7,10-13H2,1-3H3,(H,21,24)(H,22,26)
InChIKeyCPDQIZLHYASFTI-UHFFFAOYSA-N
MW360.46 g/mol
LogP1.37
Rot. Bonds6

About N-tert-butyl-2-[[2-oxo-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]ethyl]amino]benzamide

N-tert-butyl-2-[[2-oxo-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]ethyl]amino]benzamide (PubChem CID 47077618) has the molecular formula C19H28N4O3 and a molecular weight of 360.46 g/mol. Its IUPAC name is N-tert-butyl-2-[[2-oxo-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]ethyl]amino]benzamide.

Molecular Properties

Compound NameN-tert-butyl-2-[[2-oxo-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]ethyl]amino]benzamide
PubChem CID47077618
Molecular FormulaC19H28N4O3
Molecular Weight360.46 g/mol
Exact Mass360.22
IUPAC NameN-tert-butyl-2-[[2-oxo-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]ethyl]amino]benzamide
SMILESCC(C)(C)NC(=O)c1ccccc1NCC(=O)NCC(=O)N1CCCC1
InChIInChI=1S/C19H28N4O3/c1-19(2,3)22-18(26)14-8-4-5-9-15(14)20-12-16(24)21-13-17(25)23-10-6-7-11-23/h4-5,8-9,20H,6-7,10-13H2,1-3H3,(H,21,24)(H,22,26)
InChIKeyCPDQIZLHYASFTI-UHFFFAOYSA-N
XLogP1.37
TPSA90.54 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.46
LogP ≤ 51.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-tert-butyl-2-[[2-oxo-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]ethyl]amino]benzamide with MolForge

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Related Compounds

2-[[2-(azocan-1-yl)-2-oxoethyl]amino]-N-prop-2-enylbenzamide
CID 86911517
2-[[2-(azocan-1-yl)-2-oxoethyl]amino]-N-cyclopropylbenzamide
CID 51260492
2-(2-tert-butylanilino)-1-piperidin-1-ylethanone
CID 60685891
2-[2-[[acetyl(ethyl)amino]methyl]anilino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
CID 86826316
2-[[2-(3-methylpiperidin-1-yl)-2-oxoethyl]amino]-N-(2,2,2-trifluoroethyl)benzamide
CID 43037378
3-hydroxy-N-(2-oxo-2-pyrrolidin-1-ylethyl)-3-phenylbutanamide
CID 110024517
N-(2-methylpropyl)-2-[[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]amino]benzamide
CID 32987501
4-(2-benzamidoacetyl)-N-tert-butyl-1,4-diazepane-1-carboxamide
CID 110813314
2-[2-[(3,5-dichloro-2-pyridinyl)oxy]anilino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
CID 60562318
2-(2-chlorophenyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide
CID 110712323
2-(2-bromophenyl)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
CID 112990865
2-methoxy-N-(2-oxo-2-piperidin-1-ylethyl)benzamide
CID 36866031

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-[[2-oxo-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]ethyl]amino]benzamide?
The IUPAC name of N-tert-butyl-2-[[2-oxo-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]ethyl]amino]benzamide (CID 47077618) is N-tert-butyl-2-[[2-oxo-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]ethyl]amino]benzamide.
What is the SMILES notation for N-tert-butyl-2-[[2-oxo-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]ethyl]amino]benzamide?
The canonical SMILES for N-tert-butyl-2-[[2-oxo-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]ethyl]amino]benzamide is CC(C)(C)NC(=O)c1ccccc1NCC(=O)NCC(=O)N1CCCC1.
What is the InChIKey of N-tert-butyl-2-[[2-oxo-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]ethyl]amino]benzamide?
The InChIKey is CPDQIZLHYASFTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N4O3/c1-19(2,3)22-18(26)14-8-4-5-9-15(14)20-12-16(24)21-13-17(25)23-10-6-7-11-23/h4-5,8-9,20H,6-7,10-13H2,1-3H3,(H,21,24)(H,22,26).
What are the key properties of N-tert-butyl-2-[[2-oxo-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]ethyl]amino]benzamide?
N-tert-butyl-2-[[2-oxo-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]ethyl]amino]benzamide has a molecular weight of 360.46 g/mol, XLogP of 1.37, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-[[2-oxo-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]ethyl]amino]benzamide is sourced from PubChem (CID 47077618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).