N',2-dimethylpropanediamide

C5H10N2O2 — CID 19785845

IUPACN',2-dimethylpropanediamide
SMILESCNC(=O)C(C)C(N)=O
InChIInChI=1S/C5H10N2O2/c1-3(4(6)8)5(9)7-2/h3H,1-2H3,(H2,6,8)(H,7,9)
InChIKeyZTECTERUXMCZCX-UHFFFAOYSA-N
MW130.15 g/mol
LogP-1.15
Rot. Bonds2

About N',2-dimethylpropanediamide

N',2-dimethylpropanediamide (PubChem CID 19785845) has the molecular formula C5H10N2O2 and a molecular weight of 130.15 g/mol. Its IUPAC name is N',2-dimethylpropanediamide.

Molecular Properties

Compound NameN',2-dimethylpropanediamide
PubChem CID19785845
Molecular FormulaC5H10N2O2
Molecular Weight130.15 g/mol
Exact Mass130.07
IUPAC NameN',2-dimethylpropanediamide
SMILESCNC(=O)C(C)C(N)=O
InChIInChI=1S/C5H10N2O2/c1-3(4(6)8)5(9)7-2/h3H,1-2H3,(H2,6,8)(H,7,9)
InChIKeyZTECTERUXMCZCX-UHFFFAOYSA-N
XLogP-1.15
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.15
LogP ≤ 5-1.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Related Compounds

sodium 3-amino-2-methyl-3-oxopropanoate
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(2S)-2-amino-N-[(2S)-1-(methylamino)-1-oxopropan-2-yl]propanamide
CID 14888125
2-(chloroamino)-N-methylpropanamide
CID 19827989
2-[(1-amino-1-hydroxyiminopropan-2-yl)amino]-N-methylpropanamide
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N,2,3,4,5,6-hexamethylhepta-3,5-dienamide
CID 3631185
acetic acid;2-amino-N-methylpropanamide
CID 71335706
N-methyl-2-methylsulfonylpropanamide
CID 54261132
(2R)-2-chloro-N-methylpropanamide
CID 7130812
2-[[2-(carbamoylamino)-2-oxoethyl]amino]-N-methylpropanamide
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2-[(2-amino-2-oxoethoxy)amino]-N-methylpropanamide
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Frequently Asked Questions

What is the IUPAC name of N',2-dimethylpropanediamide?
The IUPAC name of N',2-dimethylpropanediamide (CID 19785845) is N',2-dimethylpropanediamide.
What is the SMILES notation for N',2-dimethylpropanediamide?
The canonical SMILES for N',2-dimethylpropanediamide is CNC(=O)C(C)C(N)=O.
What is the InChIKey of N',2-dimethylpropanediamide?
The InChIKey is ZTECTERUXMCZCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O2/c1-3(4(6)8)5(9)7-2/h3H,1-2H3,(H2,6,8)(H,7,9).
What are the key properties of N',2-dimethylpropanediamide?
N',2-dimethylpropanediamide has a molecular weight of 130.15 g/mol, XLogP of -1.15, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N',2-dimethylpropanediamide is sourced from PubChem (CID 19785845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).