N-butan-2-yl-2-[2-(dimethylamino)ethylamino]acetamide

C10H23N3O — CID 43180189

IUPACN-butan-2-yl-2-[2-(dimethylamino)ethylamino]acetamide
SMILESCCC(C)NC(=O)CNCCN(C)C
InChIInChI=1S/C10H23N3O/c1-5-9(2)12-10(14)8-11-6-7-13(3)4/h9,11H,5-8H2,1-4H3,(H,12,14)
InChIKeyOPPZZPWHXDIYTN-UHFFFAOYSA-N
MW201.31 g/mol
LogP0.05
Rot. Bonds7

About N-butan-2-yl-2-[2-(dimethylamino)ethylamino]acetamide

N-butan-2-yl-2-[2-(dimethylamino)ethylamino]acetamide (PubChem CID 43180189) has the molecular formula C10H23N3O and a molecular weight of 201.31 g/mol. Its IUPAC name is N-butan-2-yl-2-[2-(dimethylamino)ethylamino]acetamide.

Molecular Properties

Compound NameN-butan-2-yl-2-[2-(dimethylamino)ethylamino]acetamide
PubChem CID43180189
Molecular FormulaC10H23N3O
Molecular Weight201.31 g/mol
Exact Mass201.18
IUPAC NameN-butan-2-yl-2-[2-(dimethylamino)ethylamino]acetamide
SMILESCCC(C)NC(=O)CNCCN(C)C
InChIInChI=1S/C10H23N3O/c1-5-9(2)12-10(14)8-11-6-7-13(3)4/h9,11H,5-8H2,1-4H3,(H,12,14)
InChIKeyOPPZZPWHXDIYTN-UHFFFAOYSA-N
XLogP0.05
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-butan-2-yl-2-(octylamino)acetamide
CID 78914360
N-butan-2-yl-2-(3-methylsulfanylpropylamino)acetamide
CID 63964905
N-butan-2-yl-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide
CID 43179646
N-butan-2-yl-2-[[2-(tert-butylamino)-2-oxoethyl]amino]acetamide
CID 113219551
N-[2-[[2-(butan-2-ylamino)-2-oxoethyl]amino]ethyl]cyclopropanecarboxamide
CID 113219499
N-butan-2-yl-2-[2-[cyclopropyl(methyl)amino]propylamino]acetamide
CID 114133096
2-[2-(dimethylamino)ethylamino]-N-(4-propan-2-ylphenyl)acetamide
CID 108994500
N-butan-2-yl-2-(2,2-dimethylbutylamino)acetamide
CID 103461294
ethyl 2-[[2-(butan-2-ylamino)-2-oxoethyl]amino]acetate
CID 60811242
3-[(2-amino-2-hydroxyiminoethyl)amino]-N-butan-2-ylpropanamide
CID 77030584
2-[4-(dimethylamino)butan-2-ylamino]-N-pentan-2-ylacetamide
CID 54963536
N-butan-2-yl-2-[3-(dimethylamino)propyl-methylsulfonylamino]acetamide
CID 113150085

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-2-[2-(dimethylamino)ethylamino]acetamide?
The IUPAC name of N-butan-2-yl-2-[2-(dimethylamino)ethylamino]acetamide (CID 43180189) is N-butan-2-yl-2-[2-(dimethylamino)ethylamino]acetamide.
What is the SMILES notation for N-butan-2-yl-2-[2-(dimethylamino)ethylamino]acetamide?
The canonical SMILES for N-butan-2-yl-2-[2-(dimethylamino)ethylamino]acetamide is CCC(C)NC(=O)CNCCN(C)C.
What is the InChIKey of N-butan-2-yl-2-[2-(dimethylamino)ethylamino]acetamide?
The InChIKey is OPPZZPWHXDIYTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3O/c1-5-9(2)12-10(14)8-11-6-7-13(3)4/h9,11H,5-8H2,1-4H3,(H,12,14).
What are the key properties of N-butan-2-yl-2-[2-(dimethylamino)ethylamino]acetamide?
N-butan-2-yl-2-[2-(dimethylamino)ethylamino]acetamide has a molecular weight of 201.31 g/mol, XLogP of 0.05, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-2-[2-(dimethylamino)ethylamino]acetamide is sourced from PubChem (CID 43180189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).