N-[2-(benzylamino)-2-oxoethyl]-2,2-dimethylpropanamide

C14H20N2O2 — CID 36895898

IUPACN-[2-(benzylamino)-2-oxoethyl]-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)NCC(=O)NCc1ccccc1
InChIInChI=1S/C14H20N2O2/c1-14(2,3)13(18)16-10-12(17)15-9-11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3,(H,15,17)(H,16,18)
InChIKeyCTNNADKCMSWMMG-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.47
Rot. Bonds4

About N-[2-(benzylamino)-2-oxoethyl]-2,2-dimethylpropanamide

N-[2-(benzylamino)-2-oxoethyl]-2,2-dimethylpropanamide (PubChem CID 36895898) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-[2-(benzylamino)-2-oxoethyl]-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-[2-(benzylamino)-2-oxoethyl]-2,2-dimethylpropanamide
PubChem CID36895898
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN-[2-(benzylamino)-2-oxoethyl]-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)NCC(=O)NCc1ccccc1
InChIInChI=1S/C14H20N2O2/c1-14(2,3)13(18)16-10-12(17)15-9-11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3,(H,15,17)(H,16,18)
InChIKeyCTNNADKCMSWMMG-UHFFFAOYSA-N
XLogP1.47
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-[2-(benzylamino)-2-oxoethyl]-3,3,3-trifluoro-2-methylpropanamide
CID 79792967
4-[[2-(benzylamino)-2-oxoethyl]amino]-2,2-dimethyl-4-oxobutanoic acid
CID 65302280
N-[2-[[4-(diethylaminomethyl)phenyl]methylamino]-2-oxoethyl]-2,2-dimethylpropanamide
CID 31610326
N-[2-[(2-hydroxy-2-phenylethyl)amino]-2-oxoethyl]-2,2-dimethylpropanamide
CID 43416331
tert-butyl N-[2-(benzylamino)-2-oxoethyl]carbamate;methanamine
CID 145259972
N-[2-[[2-[(dimethylamino)methyl]phenyl]methylamino]-2-oxoethyl]-2,2-dimethylpropanamide
CID 31563060
N-benzyl-2-[(N-tert-butyl-N'-methylcarbamimidoyl)amino]acetamide
CID 110965255
3-[[2-(benzylamino)-2-oxoethyl]amino]-N,2,2-trimethylpropanamide
CID 106277093
N-benzyl-2-hydrazinylacetamide
CID 15514349
N-benzyl-4,4-dimethylpentanamide
CID 59836653
N-benzyl-2-(carbamothioylamino)acetamide
CID 86103801
N-benzyl-2-(methoxyamino)acetamide
CID 60702706

Frequently Asked Questions

What is the IUPAC name of N-[2-(benzylamino)-2-oxoethyl]-2,2-dimethylpropanamide?
The IUPAC name of N-[2-(benzylamino)-2-oxoethyl]-2,2-dimethylpropanamide (CID 36895898) is N-[2-(benzylamino)-2-oxoethyl]-2,2-dimethylpropanamide.
What is the SMILES notation for N-[2-(benzylamino)-2-oxoethyl]-2,2-dimethylpropanamide?
The canonical SMILES for N-[2-(benzylamino)-2-oxoethyl]-2,2-dimethylpropanamide is CC(C)(C)C(=O)NCC(=O)NCc1ccccc1.
What is the InChIKey of N-[2-(benzylamino)-2-oxoethyl]-2,2-dimethylpropanamide?
The InChIKey is CTNNADKCMSWMMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-14(2,3)13(18)16-10-12(17)15-9-11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3,(H,15,17)(H,16,18).
What are the key properties of N-[2-(benzylamino)-2-oxoethyl]-2,2-dimethylpropanamide?
N-[2-(benzylamino)-2-oxoethyl]-2,2-dimethylpropanamide has a molecular weight of 248.33 g/mol, XLogP of 1.47, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(benzylamino)-2-oxoethyl]-2,2-dimethylpropanamide is sourced from PubChem (CID 36895898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).