2-[N-(2-amino-2-oxoethyl)-2-[(tert-butylamino)methyl]anilino]acetamide

C15H24N4O2 — CID 63072276

IUPAC2-[N-(2-amino-2-oxoethyl)-2-[(tert-butylamino)methyl]anilino]acetamide
SMILESCC(C)(C)NCc1ccccc1N(CC(N)=O)CC(N)=O
InChIInChI=1S/C15H24N4O2/c1-15(2,3)18-8-11-6-4-5-7-12(11)19(9-13(16)20)10-14(17)21/h4-7,18H,8-10H2,1-3H3,(H2,16,20)(H2,17,21)
InChIKeyQMFJXIFXSPNSNL-UHFFFAOYSA-N
MW292.38 g/mol
LogP0.35
Rot. Bonds7

About 2-[N-(2-amino-2-oxoethyl)-2-[(tert-butylamino)methyl]anilino]acetamide

2-[N-(2-amino-2-oxoethyl)-2-[(tert-butylamino)methyl]anilino]acetamide (PubChem CID 63072276) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-[N-(2-amino-2-oxoethyl)-2-[(tert-butylamino)methyl]anilino]acetamide.

Molecular Properties

Compound Name2-[N-(2-amino-2-oxoethyl)-2-[(tert-butylamino)methyl]anilino]acetamide
PubChem CID63072276
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name2-[N-(2-amino-2-oxoethyl)-2-[(tert-butylamino)methyl]anilino]acetamide
SMILESCC(C)(C)NCc1ccccc1N(CC(N)=O)CC(N)=O
InChIInChI=1S/C15H24N4O2/c1-15(2,3)18-8-11-6-4-5-7-12(11)19(9-13(16)20)10-14(17)21/h4-7,18H,8-10H2,1-3H3,(H2,16,20)(H2,17,21)
InChIKeyQMFJXIFXSPNSNL-UHFFFAOYSA-N
XLogP0.35
TPSA101.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 50.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-[(tert-butylamino)methyl]-N-methylanilino]-N-methylacetamide
CID 63059312
2-[N-(2-amino-2-oxoethyl)-2-(hydroxymethyl)anilino]acetamide
CID 62923312
N-[2-[(tert-butylamino)methyl]phenyl]acetamide
CID 66385215
2-[4-[(tert-butylamino)methyl]-N-ethylanilino]acetamide
CID 103103191
2-[(tert-butylamino)methyl]-N-methyl-N-phenylaniline
CID 63060146
2-[2-[(tert-butylamino)methyl]-3-chloro-N-propan-2-ylanilino]acetamide
CID 63072064
2-[2-[(tert-butylamino)methyl]phenoxy]-N-carbamoylacetamide
CID 63062382
2-[2-[(tert-butylamino)methyl]-N-pentan-3-ylanilino]ethanol
CID 63070901
2-(2-amino-N-(2-amino-2-oxoethyl)-3-methylanilino)acetamide
CID 114041266
ethyl 2-[2-[(tert-butylamino)methyl]phenoxy]propanoate
CID 63062046
2-[[5-[(tert-butylamino)methyl]pyrimidin-2-yl]-ethylamino]acetamide
CID 103103176
2-[N-butyl-2-(hydroxymethyl)anilino]acetamide
CID 55003388

Frequently Asked Questions

What is the IUPAC name of 2-[N-(2-amino-2-oxoethyl)-2-[(tert-butylamino)methyl]anilino]acetamide?
The IUPAC name of 2-[N-(2-amino-2-oxoethyl)-2-[(tert-butylamino)methyl]anilino]acetamide (CID 63072276) is 2-[N-(2-amino-2-oxoethyl)-2-[(tert-butylamino)methyl]anilino]acetamide.
What is the SMILES notation for 2-[N-(2-amino-2-oxoethyl)-2-[(tert-butylamino)methyl]anilino]acetamide?
The canonical SMILES for 2-[N-(2-amino-2-oxoethyl)-2-[(tert-butylamino)methyl]anilino]acetamide is CC(C)(C)NCc1ccccc1N(CC(N)=O)CC(N)=O.
What is the InChIKey of 2-[N-(2-amino-2-oxoethyl)-2-[(tert-butylamino)methyl]anilino]acetamide?
The InChIKey is QMFJXIFXSPNSNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-15(2,3)18-8-11-6-4-5-7-12(11)19(9-13(16)20)10-14(17)21/h4-7,18H,8-10H2,1-3H3,(H2,16,20)(H2,17,21).
What are the key properties of 2-[N-(2-amino-2-oxoethyl)-2-[(tert-butylamino)methyl]anilino]acetamide?
2-[N-(2-amino-2-oxoethyl)-2-[(tert-butylamino)methyl]anilino]acetamide has a molecular weight of 292.38 g/mol, XLogP of 0.35, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[N-(2-amino-2-oxoethyl)-2-[(tert-butylamino)methyl]anilino]acetamide is sourced from PubChem (CID 63072276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).