N-[1-(dimethylamino)-2-methylpropyl]acetamide

C8H18N2O — CID 130005288

IUPACN-[1-(dimethylamino)-2-methylpropyl]acetamide
SMILESCC(=O)NC(C(C)C)N(C)C
InChIInChI=1S/C8H18N2O/c1-6(2)8(10(4)5)9-7(3)11/h6,8H,1-5H3,(H,9,11)
InChIKeyMKZGRYNYVYLCKY-UHFFFAOYSA-N
MW158.24 g/mol
LogP0.67
Rot. Bonds3

About N-[1-(dimethylamino)-2-methylpropyl]acetamide

N-[1-(dimethylamino)-2-methylpropyl]acetamide (PubChem CID 130005288) has the molecular formula C8H18N2O and a molecular weight of 158.24 g/mol. Its IUPAC name is N-[1-(dimethylamino)-2-methylpropyl]acetamide.

Molecular Properties

Compound NameN-[1-(dimethylamino)-2-methylpropyl]acetamide
PubChem CID130005288
Molecular FormulaC8H18N2O
Molecular Weight158.24 g/mol
Exact Mass158.14
IUPAC NameN-[1-(dimethylamino)-2-methylpropyl]acetamide
SMILESCC(=O)NC(C(C)C)N(C)C
InChIInChI=1S/C8H18N2O/c1-6(2)8(10(4)5)9-7(3)11/h6,8H,1-5H3,(H,9,11)
InChIKeyMKZGRYNYVYLCKY-UHFFFAOYSA-N
XLogP0.67
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[1-(dimethylamino)ethyl]acetamide
CID 55287286
N-[5-(dimethylamino)hexan-2-yl]acetamide
CID 59721263
N-(1-acetamido-2-methylpropyl)acetamide
CID 14691990
N-[1-[acetyl(methyl)amino]ethyl]acetamide
CID 166903607
N-[dimethylamino(methylamino)methyl]acetamide
CID 131999819
N-(1-fluoroethyl)acetamide
CID 123354067
2-acetamido-N-(2-hydroxypropyl)-N,3-dimethylbutanamide
CID 62334399
N-(4-methylpent-1-yn-3-yl)acetamide
CID 123211812
(2R)-2-acetamido-3-methylbutanamide
CID 40561650
N-[1-(hydroxyamino)ethyl]acetamide;molecular hydrogen
CID 142966371
N-[1-(methylamino)ethyl]acetamide
CID 87728985
(2S)-2-(acetyl(15N)amino)propanoic acid
CID 102175488

Frequently Asked Questions

What is the IUPAC name of N-[1-(dimethylamino)-2-methylpropyl]acetamide?
The IUPAC name of N-[1-(dimethylamino)-2-methylpropyl]acetamide (CID 130005288) is N-[1-(dimethylamino)-2-methylpropyl]acetamide.
What is the SMILES notation for N-[1-(dimethylamino)-2-methylpropyl]acetamide?
The canonical SMILES for N-[1-(dimethylamino)-2-methylpropyl]acetamide is CC(=O)NC(C(C)C)N(C)C.
What is the InChIKey of N-[1-(dimethylamino)-2-methylpropyl]acetamide?
The InChIKey is MKZGRYNYVYLCKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O/c1-6(2)8(10(4)5)9-7(3)11/h6,8H,1-5H3,(H,9,11).
What are the key properties of N-[1-(dimethylamino)-2-methylpropyl]acetamide?
N-[1-(dimethylamino)-2-methylpropyl]acetamide has a molecular weight of 158.24 g/mol, XLogP of 0.67, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(dimethylamino)-2-methylpropyl]acetamide is sourced from PubChem (CID 130005288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).