N-tert-butyl-2-[3-(dimethylamino)anilino]acetamide

C14H23N3O — CID 78914160

IUPACN-tert-butyl-2-[3-(dimethylamino)anilino]acetamide
SMILESCN(C)c1cccc(NCC(=O)NC(C)(C)C)c1
InChIInChI=1S/C14H23N3O/c1-14(2,3)16-13(18)10-15-11-7-6-8-12(9-11)17(4)5/h6-9,15H,10H2,1-5H3,(H,16,18)
InChIKeyNSKUZMZNGMTIOV-UHFFFAOYSA-N
MW249.36 g/mol
LogP2.08
Rot. Bonds4

About N-tert-butyl-2-[3-(dimethylamino)anilino]acetamide

N-tert-butyl-2-[3-(dimethylamino)anilino]acetamide (PubChem CID 78914160) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is N-tert-butyl-2-[3-(dimethylamino)anilino]acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-[3-(dimethylamino)anilino]acetamide
PubChem CID78914160
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC NameN-tert-butyl-2-[3-(dimethylamino)anilino]acetamide
SMILESCN(C)c1cccc(NCC(=O)NC(C)(C)C)c1
InChIInChI=1S/C14H23N3O/c1-14(2,3)16-13(18)10-15-11-7-6-8-12(9-11)17(4)5/h6-9,15H,10H2,1-5H3,(H,16,18)
InChIKeyNSKUZMZNGMTIOV-UHFFFAOYSA-N
XLogP2.08
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[3-(dimethylamino)anilino]-N-(3-methylbutan-2-yl)acetamide
CID 78914085
2-[[3-(dimethylamino)anilino]methyl]prop-2-enoic acid
CID 103260479
3-[[2-(tert-butylamino)-2-oxoethyl]amino]-N,N-diethylbenzamide
CID 54832401
2-[4-[acetyl(methyl)amino]anilino]-N-tert-butylacetamide
CID 54811252
methyl 3-[3-(dimethylamino)anilino]propanoate
CID 80504001
N-tert-butyl-2-(3-heptoxyanilino)acetamide
CID 54829073
2-amino-3-[3-(dimethylamino)anilino]propanoic acid
CID 103260466
2-(3-chloroanilino)-N-[4-(dimethylamino)phenyl]acetamide
CID 109008440
[3-(dimethylamino)phenyl]carbamic acid
CID 91129511
2-(4-acetamidoanilino)-N-tert-butylacetamide
CID 28567256
3-(3-acetamido-N-acetylanilino)-N-tert-butylpropanamide
CID 113130989
N-tert-butyl-3-[[2-(ethylamino)-2-oxoethyl]amino]benzamide
CID 54844517

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-[3-(dimethylamino)anilino]acetamide?
The IUPAC name of N-tert-butyl-2-[3-(dimethylamino)anilino]acetamide (CID 78914160) is N-tert-butyl-2-[3-(dimethylamino)anilino]acetamide.
What is the SMILES notation for N-tert-butyl-2-[3-(dimethylamino)anilino]acetamide?
The canonical SMILES for N-tert-butyl-2-[3-(dimethylamino)anilino]acetamide is CN(C)c1cccc(NCC(=O)NC(C)(C)C)c1.
What is the InChIKey of N-tert-butyl-2-[3-(dimethylamino)anilino]acetamide?
The InChIKey is NSKUZMZNGMTIOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-14(2,3)16-13(18)10-15-11-7-6-8-12(9-11)17(4)5/h6-9,15H,10H2,1-5H3,(H,16,18).
What are the key properties of N-tert-butyl-2-[3-(dimethylamino)anilino]acetamide?
N-tert-butyl-2-[3-(dimethylamino)anilino]acetamide has a molecular weight of 249.36 g/mol, XLogP of 2.08, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-[3-(dimethylamino)anilino]acetamide is sourced from PubChem (CID 78914160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).