2-(dimethylamino)-N-[(dimethylamino)methyl]-N-methylpropanamide

C9H21N3O — CID 59934762

IUPAC2-(dimethylamino)-N-[(dimethylamino)methyl]-N-methylpropanamide
SMILESCC(C(=O)N(C)CN(C)C)N(C)C
InChIInChI=1S/C9H21N3O/c1-8(11(4)5)9(13)12(6)7-10(2)3/h8H,7H2,1-6H3
InChIKeyGFYFPOKIRHYFMX-UHFFFAOYSA-N
MW187.29 g/mol
LogP-0.09
Rot. Bonds4

About 2-(dimethylamino)-N-[(dimethylamino)methyl]-N-methylpropanamide

2-(dimethylamino)-N-[(dimethylamino)methyl]-N-methylpropanamide (PubChem CID 59934762) has the molecular formula C9H21N3O and a molecular weight of 187.29 g/mol. Its IUPAC name is 2-(dimethylamino)-N-[(dimethylamino)methyl]-N-methylpropanamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-[(dimethylamino)methyl]-N-methylpropanamide
PubChem CID59934762
Molecular FormulaC9H21N3O
Molecular Weight187.29 g/mol
Exact Mass187.17
IUPAC Name2-(dimethylamino)-N-[(dimethylamino)methyl]-N-methylpropanamide
SMILESCC(C(=O)N(C)CN(C)C)N(C)C
InChIInChI=1S/C9H21N3O/c1-8(11(4)5)9(13)12(6)7-10(2)3/h8H,7H2,1-6H3
InChIKeyGFYFPOKIRHYFMX-UHFFFAOYSA-N
XLogP-0.09
TPSA26.79 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.29
LogP ≤ 5-0.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

(2S)-2-(3-ethyl-4-oxoimidazolidin-1-yl)-N,N-dimethylpropanamide
CID 164634683
5-Methyl-1,3-di(propan-2-yl)imidazolidine-2,4-dione
CID 12373160
2-(dimethylamino)-N,N-dimethylpropanamide
CID 14644896
2-[2-(dimethylamino)propyl-methylamino]-N,N-dimethylpropanamide
CID 18709993
1,3,5-Trimethylimidazolidin-4-one
CID 18721368
3-Ethyl-5-methyl-1-propan-2-ylimidazolidine-2,4-dione
CID 21132599
N-methyl-N-[[methyl(propan-2-yl)amino]methyl]acetamide
CID 21336479
1-Acetyl-2,3,5-trimethylimidazolidin-4-one
CID 23383998
(2S)-2-(dimethylamino)-N,N-dimethylpropanamide
CID 51669462
5-Methyl-1,3-dipropylimidazolidine-2,4-dione
CID 57688815
(5R)-3-ethyl-5-methyl-1-propan-2-ylimidazolidine-2,4-dione
CID 59075674
N,2-dimethyl-N-[[methyl(propan-2-yl)amino]methyl]propanamide
CID 59961758

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-[(dimethylamino)methyl]-N-methylpropanamide?
The IUPAC name of 2-(dimethylamino)-N-[(dimethylamino)methyl]-N-methylpropanamide (CID 59934762) is 2-(dimethylamino)-N-[(dimethylamino)methyl]-N-methylpropanamide.
What is the SMILES notation for 2-(dimethylamino)-N-[(dimethylamino)methyl]-N-methylpropanamide?
The canonical SMILES for 2-(dimethylamino)-N-[(dimethylamino)methyl]-N-methylpropanamide is CC(C(=O)N(C)CN(C)C)N(C)C.
What is the InChIKey of 2-(dimethylamino)-N-[(dimethylamino)methyl]-N-methylpropanamide?
The InChIKey is GFYFPOKIRHYFMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N3O/c1-8(11(4)5)9(13)12(6)7-10(2)3/h8H,7H2,1-6H3.
What are the key properties of 2-(dimethylamino)-N-[(dimethylamino)methyl]-N-methylpropanamide?
2-(dimethylamino)-N-[(dimethylamino)methyl]-N-methylpropanamide has a molecular weight of 187.29 g/mol, XLogP of -0.09, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-[(dimethylamino)methyl]-N-methylpropanamide is sourced from PubChem (CID 59934762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).