3-(2-amino-2-methylpropoxy)-N,N-dimethylpropanamide

C9H20N2O2 — CID 64537384

IUPAC3-(2-amino-2-methylpropoxy)-N,N-dimethylpropanamide
SMILESCN(C)C(=O)CCOCC(C)(C)N
InChIInChI=1S/C9H20N2O2/c1-9(2,10)7-13-6-5-8(12)11(3)4/h5-7,10H2,1-4H3
InChIKeyRERQLWQHBFNNAZ-UHFFFAOYSA-N
MW188.27 g/mol
LogP0.22
Rot. Bonds5

About 3-(2-amino-2-methylpropoxy)-N,N-dimethylpropanamide

3-(2-amino-2-methylpropoxy)-N,N-dimethylpropanamide (PubChem CID 64537384) has the molecular formula C9H20N2O2 and a molecular weight of 188.27 g/mol. Its IUPAC name is 3-(2-amino-2-methylpropoxy)-N,N-dimethylpropanamide.

Molecular Properties

Compound Name3-(2-amino-2-methylpropoxy)-N,N-dimethylpropanamide
PubChem CID64537384
Molecular FormulaC9H20N2O2
Molecular Weight188.27 g/mol
Exact Mass188.15
IUPAC Name3-(2-amino-2-methylpropoxy)-N,N-dimethylpropanamide
SMILESCN(C)C(=O)CCOCC(C)(C)N
InChIInChI=1S/C9H20N2O2/c1-9(2,10)7-13-6-5-8(12)11(3)4/h5-7,10H2,1-4H3
InChIKeyRERQLWQHBFNNAZ-UHFFFAOYSA-N
XLogP0.22
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-[2-[2-[2-[3-(dimethylamino)-3-oxopropoxy]ethoxy]ethoxy]ethoxy]-N,N-dimethylpropanamide
CID 71364213
N,N-dimethyl-3-octadecoxypropanamide
CID 155355336
3-methoxy-N,N-dimethylpropanamide
CID 159478663
3-butoxy-N,N-dimethylpropanamide;3-methoxy-N,N-dimethylpropanamide
CID 141458250
N-[2-(2-aminoethoxy)ethyl]-N-methyl-3-(2,2,2-trifluoroethoxy)propanamide
CID 114243684
[3-(dimethylamino)-3-oxopropyl] 2-methylpropanoate
CID 134364570
N-(2-chloroethyl)-N-methyl-3-(2,2,2-trifluoroethoxy)propanamide
CID 103212140
3-amino-N-[3-(dimethylamino)-3-oxopropyl]-3-methylbutanamide
CID 64684461
1-(3,3-dimethylbutoxy)-2-methylpropan-2-amine
CID 64537370
4-(2-amino-2-methylpropyl)sulfinyl-N,N-dimethylbutanamide
CID 81189824
3-(2-aminoethoxy)-N-ethyl-N-methylpropanamide
CID 162436526
N-(1-chloropropan-2-yl)-N-methyl-3-(2,2,2-trifluoroethoxy)propanamide
CID 103212667

Frequently Asked Questions

What is the IUPAC name of 3-(2-amino-2-methylpropoxy)-N,N-dimethylpropanamide?
The IUPAC name of 3-(2-amino-2-methylpropoxy)-N,N-dimethylpropanamide (CID 64537384) is 3-(2-amino-2-methylpropoxy)-N,N-dimethylpropanamide.
What is the SMILES notation for 3-(2-amino-2-methylpropoxy)-N,N-dimethylpropanamide?
The canonical SMILES for 3-(2-amino-2-methylpropoxy)-N,N-dimethylpropanamide is CN(C)C(=O)CCOCC(C)(C)N.
What is the InChIKey of 3-(2-amino-2-methylpropoxy)-N,N-dimethylpropanamide?
The InChIKey is RERQLWQHBFNNAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O2/c1-9(2,10)7-13-6-5-8(12)11(3)4/h5-7,10H2,1-4H3.
What are the key properties of 3-(2-amino-2-methylpropoxy)-N,N-dimethylpropanamide?
3-(2-amino-2-methylpropoxy)-N,N-dimethylpropanamide has a molecular weight of 188.27 g/mol, XLogP of 0.22, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-amino-2-methylpropoxy)-N,N-dimethylpropanamide is sourced from PubChem (CID 64537384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).