N,N-dimethyl-2-(3-propan-2-ylanilino)acetamide

C13H20N2O — CID 28837936

IUPACN,N-dimethyl-2-(3-propan-2-ylanilino)acetamide
SMILESCC(C)c1cccc(NCC(=O)N(C)C)c1
InChIInChI=1S/C13H20N2O/c1-10(2)11-6-5-7-12(8-11)14-9-13(16)15(3)4/h5-8,10,14H,9H2,1-4H3
InChIKeyHNQKPSGDDGKQPF-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.31
Rot. Bonds4

About N,N-dimethyl-2-(3-propan-2-ylanilino)acetamide

N,N-dimethyl-2-(3-propan-2-ylanilino)acetamide (PubChem CID 28837936) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is N,N-dimethyl-2-(3-propan-2-ylanilino)acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-(3-propan-2-ylanilino)acetamide
PubChem CID28837936
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC NameN,N-dimethyl-2-(3-propan-2-ylanilino)acetamide
SMILESCC(C)c1cccc(NCC(=O)N(C)C)c1
InChIInChI=1S/C13H20N2O/c1-10(2)11-6-5-7-12(8-11)14-9-13(16)15(3)4/h5-8,10,14H,9H2,1-4H3
InChIKeyHNQKPSGDDGKQPF-UHFFFAOYSA-N
XLogP2.31
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 2-(3-propan-2-ylanilino)acetate
CID 20824069
N,N-dimethyl-2-(2-methyl-5-propan-2-ylanilino)acetamide
CID 82496447
1-(dimethylamino)-3-(3-propan-2-ylanilino)propan-2-ol
CID 60900023
N-benzyl-2-(3-propan-2-ylanilino)acetamide
CID 28829787
2-(3-propan-2-ylanilino)ethanol
CID 28973580
3-[[amino-(3-propan-2-ylanilino)methylidene]amino]-N,N-dimethylpropanamide;hydroiodide
CID 111068232
2-(3-iodoanilino)-N-methyl-N-propan-2-ylacetamide
CID 28879230
N,N-dimethyl-2-[4-[(3-propan-2-ylphenyl)carbamoylamino]pyrazol-1-yl]acetamide
CID 56793742
N-(methylsulfanylmethyl)-3-propan-2-ylaniline
CID 139386106
3-methyl-N-(3-propan-2-ylphenyl)butanamide
CID 21491914
N,N-dimethyl-2-(4-pentan-3-ylanilino)acetamide
CID 126626051
1-chloro-3-(3-propan-2-ylanilino)propan-2-ol
CID 168640793

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(3-propan-2-ylanilino)acetamide?
The IUPAC name of N,N-dimethyl-2-(3-propan-2-ylanilino)acetamide (CID 28837936) is N,N-dimethyl-2-(3-propan-2-ylanilino)acetamide.
What is the SMILES notation for N,N-dimethyl-2-(3-propan-2-ylanilino)acetamide?
The canonical SMILES for N,N-dimethyl-2-(3-propan-2-ylanilino)acetamide is CC(C)c1cccc(NCC(=O)N(C)C)c1.
What is the InChIKey of N,N-dimethyl-2-(3-propan-2-ylanilino)acetamide?
The InChIKey is HNQKPSGDDGKQPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-10(2)11-6-5-7-12(8-11)14-9-13(16)15(3)4/h5-8,10,14H,9H2,1-4H3.
What are the key properties of N,N-dimethyl-2-(3-propan-2-ylanilino)acetamide?
N,N-dimethyl-2-(3-propan-2-ylanilino)acetamide has a molecular weight of 220.32 g/mol, XLogP of 2.31, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(3-propan-2-ylanilino)acetamide is sourced from PubChem (CID 28837936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).