2-[3-(dimethylamino)anilino]-N-(3-methylbutan-2-yl)acetamide

C15H25N3O — CID 78914085

IUPAC2-[3-(dimethylamino)anilino]-N-(3-methylbutan-2-yl)acetamide
SMILESCC(C)C(C)NC(=O)CNc1cccc(N(C)C)c1
InChIInChI=1S/C15H25N3O/c1-11(2)12(3)17-15(19)10-16-13-7-6-8-14(9-13)18(4)5/h6-9,11-12,16H,10H2,1-5H3,(H,17,19)
InChIKeyHEYLUESAAVHDIF-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.33
Rot. Bonds6

About 2-[3-(dimethylamino)anilino]-N-(3-methylbutan-2-yl)acetamide

2-[3-(dimethylamino)anilino]-N-(3-methylbutan-2-yl)acetamide (PubChem CID 78914085) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 2-[3-(dimethylamino)anilino]-N-(3-methylbutan-2-yl)acetamide.

Molecular Properties

Compound Name2-[3-(dimethylamino)anilino]-N-(3-methylbutan-2-yl)acetamide
PubChem CID78914085
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name2-[3-(dimethylamino)anilino]-N-(3-methylbutan-2-yl)acetamide
SMILESCC(C)C(C)NC(=O)CNc1cccc(N(C)C)c1
InChIInChI=1S/C15H25N3O/c1-11(2)12(3)17-15(19)10-16-13-7-6-8-14(9-13)18(4)5/h6-9,11-12,16H,10H2,1-5H3,(H,17,19)
InChIKeyHEYLUESAAVHDIF-UHFFFAOYSA-N
XLogP2.33
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-(dimethylamino)anilino]-N-(3-methylbutan-2-yl)acetamide
CID 60685378
N-tert-butyl-2-[3-(dimethylamino)anilino]acetamide
CID 78914160
2-(3-ethylanilino)-N-(3-methylbutan-2-yl)acetamide
CID 60688155
2-[3-(2-methoxyethoxy)anilino]-N-(3-methylbutan-2-yl)acetamide
CID 87029683
2-[[3-(dimethylamino)anilino]methyl]prop-2-enoic acid
CID 103260479
2-amino-3-[3-(dimethylamino)anilino]propanoic acid
CID 103260466
3-N,3-N-dimethyl-1-N-(3-methyl-2-propan-2-ylbutyl)benzene-1,3-diamine
CID 114281857
2-(butan-2-ylamino)-N-[3-(dimethylamino)phenyl]acetamide
CID 115376908
2-[(6-bromonaphthalen-2-yl)amino]-N-(3-methylbutan-2-yl)acetamide
CID 81266788
2-(2,6-diethylanilino)-N-(3-methylbutan-2-yl)acetamide
CID 62328197
methyl 3-[3-(dimethylamino)anilino]propanoate
CID 80504001
methyl 2-bromo-3-[3-(dimethylamino)anilino]propanoate
CID 103260461

Frequently Asked Questions

What is the IUPAC name of 2-[3-(dimethylamino)anilino]-N-(3-methylbutan-2-yl)acetamide?
The IUPAC name of 2-[3-(dimethylamino)anilino]-N-(3-methylbutan-2-yl)acetamide (CID 78914085) is 2-[3-(dimethylamino)anilino]-N-(3-methylbutan-2-yl)acetamide.
What is the SMILES notation for 2-[3-(dimethylamino)anilino]-N-(3-methylbutan-2-yl)acetamide?
The canonical SMILES for 2-[3-(dimethylamino)anilino]-N-(3-methylbutan-2-yl)acetamide is CC(C)C(C)NC(=O)CNc1cccc(N(C)C)c1.
What is the InChIKey of 2-[3-(dimethylamino)anilino]-N-(3-methylbutan-2-yl)acetamide?
The InChIKey is HEYLUESAAVHDIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-11(2)12(3)17-15(19)10-16-13-7-6-8-14(9-13)18(4)5/h6-9,11-12,16H,10H2,1-5H3,(H,17,19).
What are the key properties of 2-[3-(dimethylamino)anilino]-N-(3-methylbutan-2-yl)acetamide?
2-[3-(dimethylamino)anilino]-N-(3-methylbutan-2-yl)acetamide has a molecular weight of 263.38 g/mol, XLogP of 2.33, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(dimethylamino)anilino]-N-(3-methylbutan-2-yl)acetamide is sourced from PubChem (CID 78914085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).