N-tert-butyl-2-[2-(diethylamino)ethylamino]-2-phenylacetamide

C18H31N3O — CID 54271969

IUPACN-tert-butyl-2-[2-(diethylamino)ethylamino]-2-phenylacetamide
SMILESCCN(CC)CCNC(C(=O)NC(C)(C)C)c1ccccc1
InChIInChI=1S/C18H31N3O/c1-6-21(7-2)14-13-19-16(15-11-9-8-10-12-15)17(22)20-18(3,4)5/h8-12,16,19H,6-7,13-14H2,1-5H3,(H,20,22)
InChIKeyRKUCFZDMYRSAFO-UHFFFAOYSA-N
MW305.47 g/mol
LogP2.57
Rot. Bonds8

About N-tert-butyl-2-[2-(diethylamino)ethylamino]-2-phenylacetamide

N-tert-butyl-2-[2-(diethylamino)ethylamino]-2-phenylacetamide (PubChem CID 54271969) has the molecular formula C18H31N3O and a molecular weight of 305.47 g/mol. Its IUPAC name is N-tert-butyl-2-[2-(diethylamino)ethylamino]-2-phenylacetamide.

Molecular Properties

Compound NameN-tert-butyl-2-[2-(diethylamino)ethylamino]-2-phenylacetamide
PubChem CID54271969
Molecular FormulaC18H31N3O
Molecular Weight305.47 g/mol
Exact Mass305.25
IUPAC NameN-tert-butyl-2-[2-(diethylamino)ethylamino]-2-phenylacetamide
SMILESCCN(CC)CCNC(C(=O)NC(C)(C)C)c1ccccc1
InChIInChI=1S/C18H31N3O/c1-6-21(7-2)14-13-19-16(15-11-9-8-10-12-15)17(22)20-18(3,4)5/h8-12,16,19H,6-7,13-14H2,1-5H3,(H,20,22)
InChIKeyRKUCFZDMYRSAFO-UHFFFAOYSA-N
XLogP2.57
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.47
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methylbutan-2-yl 2-[2-(diethylamino)ethylamino]-2-phenylacetate
CID 110185926
3-methylbutyl (2R)-2-[2-(diethylamino)ethylamino]-2-phenylacetate
CID 51590030
(2R)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[2-(diethylamino)ethylamino]-2-phenylacetamide
CID 2427757
2-[2-(diethylamino)ethylamino]-2-[4-(dimethylamino)phenyl]acetic acid
CID 84748929
1-adamantyl 2-[2-(diethylamino)ethylamino]-2-phenylacetate
CID 110186176
N-(2-bromo-4-nitrophenyl)-2-[2-(diethylamino)ethylamino]-2-phenylacetamide
CID 5233772
2-(2-chlorophenyl)-2-[2-(diethylamino)ethylamino]acetic acid
CID 54890478
decan-4-yl 2-[2-(diethylamino)ethylamino]-2-phenylacetate
CID 110186212
2-[2-(diethylamino)ethylamino]-2-(4-ethoxyphenyl)acetic acid
CID 60993501
N-[2-(diethylamino)ethyl]-3,3-diphenylpropanamide
CID 59499353
2-[2-(diethylamino)ethylamino]-2-(2-hydroxyphenyl)acetamide
CID 116684899
methyl 2-[2-(diethylamino)ethylamino]-2-(4-hydroxyphenyl)acetate
CID 60993508

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-[2-(diethylamino)ethylamino]-2-phenylacetamide?
The IUPAC name of N-tert-butyl-2-[2-(diethylamino)ethylamino]-2-phenylacetamide (CID 54271969) is N-tert-butyl-2-[2-(diethylamino)ethylamino]-2-phenylacetamide.
What is the SMILES notation for N-tert-butyl-2-[2-(diethylamino)ethylamino]-2-phenylacetamide?
The canonical SMILES for N-tert-butyl-2-[2-(diethylamino)ethylamino]-2-phenylacetamide is CCN(CC)CCNC(C(=O)NC(C)(C)C)c1ccccc1.
What is the InChIKey of N-tert-butyl-2-[2-(diethylamino)ethylamino]-2-phenylacetamide?
The InChIKey is RKUCFZDMYRSAFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H31N3O/c1-6-21(7-2)14-13-19-16(15-11-9-8-10-12-15)17(22)20-18(3,4)5/h8-12,16,19H,6-7,13-14H2,1-5H3,(H,20,22).
What are the key properties of N-tert-butyl-2-[2-(diethylamino)ethylamino]-2-phenylacetamide?
N-tert-butyl-2-[2-(diethylamino)ethylamino]-2-phenylacetamide has a molecular weight of 305.47 g/mol, XLogP of 2.57, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-[2-(diethylamino)ethylamino]-2-phenylacetamide is sourced from PubChem (CID 54271969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).