2-amino-N-[3-(dimethylamino)propyl]-N,3-dimethylbutanamide

C11H25N3O — CID 63693134

IUPAC2-amino-N-[3-(dimethylamino)propyl]-N,3-dimethylbutanamide
SMILESCC(C)C(N)C(=O)N(C)CCCN(C)C
InChIInChI=1S/C11H25N3O/c1-9(2)10(12)11(15)14(5)8-6-7-13(3)4/h9-10H,6-8,12H2,1-5H3
InChIKeyGYDXSHKYUVEUCC-UHFFFAOYSA-N
MW215.34 g/mol
LogP0.38
Rot. Bonds6

About 2-amino-N-[3-(dimethylamino)propyl]-N,3-dimethylbutanamide

2-amino-N-[3-(dimethylamino)propyl]-N,3-dimethylbutanamide (PubChem CID 63693134) has the molecular formula C11H25N3O and a molecular weight of 215.34 g/mol. Its IUPAC name is 2-amino-N-[3-(dimethylamino)propyl]-N,3-dimethylbutanamide.

Molecular Properties

Compound Name2-amino-N-[3-(dimethylamino)propyl]-N,3-dimethylbutanamide
PubChem CID63693134
Molecular FormulaC11H25N3O
Molecular Weight215.34 g/mol
Exact Mass215.20
IUPAC Name2-amino-N-[3-(dimethylamino)propyl]-N,3-dimethylbutanamide
SMILESCC(C)C(N)C(=O)N(C)CCCN(C)C
InChIInChI=1S/C11H25N3O/c1-9(2)10(12)11(15)14(5)8-6-7-13(3)4/h9-10H,6-8,12H2,1-5H3
InChIKeyGYDXSHKYUVEUCC-UHFFFAOYSA-N
XLogP0.38
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-N,3-dimethyl-N-pent-4-enylbutanamide
CID 15511724
(2S)-2-amino-N-[3-(dimethylamino)propyl]-N-methylpentanamide
CID 107569740
(2S)-2-amino-N,3-dimethyl-N-(3-phenylpropyl)butanamide
CID 61154408
2-amino-N,3-dimethyl-N-(3-phenylpropyl)butanamide
CID 43588760
2-amino-N,3-dimethyl-N-(2-methylpropyl)butanamide
CID 43272154
2-amino-N,3-dimethyl-N-(2-oxopropyl)butanamide;ethane
CID 143701294
(2S)-2-amino-N-[3-(dimethylamino)propyl]-N-methyl-4-methylsulfanylbutanamide
CID 63693500
(2R)-2-amino-N,3-dimethyl-N-(2-phenylethyl)butanamide
CID 79012795
(2S)-2-amino-N-(2-hydroxy-2-methylpropyl)-N,3-dimethylbutanamide
CID 79377276
(2S)-2-amino-N-[2-(dimethylamino)-2-oxoethyl]-N,3-dimethylbutanamide;hydrochloride
CID 119270119
2-amino-N-[3-(dimethylamino)propyl]-N-ethylpropanamide
CID 102992838
(2R)-2-amino-N-(cyclopropylmethyl)-N,3-dimethylbutanamide
CID 79013234

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[3-(dimethylamino)propyl]-N,3-dimethylbutanamide?
The IUPAC name of 2-amino-N-[3-(dimethylamino)propyl]-N,3-dimethylbutanamide (CID 63693134) is 2-amino-N-[3-(dimethylamino)propyl]-N,3-dimethylbutanamide.
What is the SMILES notation for 2-amino-N-[3-(dimethylamino)propyl]-N,3-dimethylbutanamide?
The canonical SMILES for 2-amino-N-[3-(dimethylamino)propyl]-N,3-dimethylbutanamide is CC(C)C(N)C(=O)N(C)CCCN(C)C.
What is the InChIKey of 2-amino-N-[3-(dimethylamino)propyl]-N,3-dimethylbutanamide?
The InChIKey is GYDXSHKYUVEUCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3O/c1-9(2)10(12)11(15)14(5)8-6-7-13(3)4/h9-10H,6-8,12H2,1-5H3.
What are the key properties of 2-amino-N-[3-(dimethylamino)propyl]-N,3-dimethylbutanamide?
2-amino-N-[3-(dimethylamino)propyl]-N,3-dimethylbutanamide has a molecular weight of 215.34 g/mol, XLogP of 0.38, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[3-(dimethylamino)propyl]-N,3-dimethylbutanamide is sourced from PubChem (CID 63693134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).