N-(2-amino-1-cyclopropylethyl)-N',N'-dimethylpropanediamide;hydrochloride

C10H20ClN3O2 — CID 119613235

IUPACN-(2-amino-1-cyclopropylethyl)-N',N'-dimethylpropanediamide;hydrochloride
SMILESCN(C)C(=O)CC(=O)NC(CN)C1CC1.Cl
InChIInChI=1S/C10H19N3O2.ClH/c1-13(2)10(15)5-9(14)12-8(6-11)7-3-4-7;/h7-8H,3-6,11H2,1-2H3,(H,12,14);1H
InChIKeyDPSHNVWQLGMMQJ-UHFFFAOYSA-N
MW249.74 g/mol
LogP-0.26
Rot. Bonds5

About N-(2-amino-1-cyclopropylethyl)-N',N'-dimethylpropanediamide;hydrochloride

N-(2-amino-1-cyclopropylethyl)-N',N'-dimethylpropanediamide;hydrochloride (PubChem CID 119613235) has the molecular formula C10H20ClN3O2 and a molecular weight of 249.74 g/mol. Its IUPAC name is N-(2-amino-1-cyclopropylethyl)-N',N'-dimethylpropanediamide;hydrochloride.

Molecular Properties

Compound NameN-(2-amino-1-cyclopropylethyl)-N',N'-dimethylpropanediamide;hydrochloride
PubChem CID119613235
Molecular FormulaC10H20ClN3O2
Molecular Weight249.74 g/mol
Exact Mass249.12
IUPAC NameN-(2-amino-1-cyclopropylethyl)-N',N'-dimethylpropanediamide;hydrochloride
SMILESCN(C)C(=O)CC(=O)NC(CN)C1CC1.Cl
InChIInChI=1S/C10H19N3O2.ClH/c1-13(2)10(15)5-9(14)12-8(6-11)7-3-4-7;/h7-8H,3-6,11H2,1-2H3,(H,12,14);1H
InChIKeyDPSHNVWQLGMMQJ-UHFFFAOYSA-N
XLogP-0.26
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.74
LogP ≤ 5-0.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2-amino-1-cyclopentylethyl)-2-(dimethylamino)acetamide
CID 106737390
N-(2-amino-1-cyclohexylethyl)-2-[methyl(methylsulfonyl)amino]acetamide;hydrochloride
CID 119590776
N-(2-amino-1-cyclopropylethyl)-3-(2-methoxyethoxy)propanamide;hydrochloride
CID 119617078
N-(2-amino-1-cyclopentylethyl)-3-methylbutanamide
CID 106737373
2-acetamido-N-(2-amino-1-cyclohexylethyl)acetamide;hydrochloride
CID 119590269
N-(2-amino-1-cyclopropylethyl)-2-[4-(2-methylpropyl)phenyl]acetamide;hydrochloride
CID 119615543
N-(2-amino-1-cyclopropylethyl)-3-(2-methylpropylsulfonyl)propanamide;hydrochloride
CID 119614320
N-(2-amino-1-cyclopropylethyl)-2,3-dimethylbutanamide
CID 65188578
N-(2-amino-1-cyclohexylethyl)pentanamide;hydrochloride
CID 119589343
N-(2-amino-1-cyclopropylethyl)-3-(2-methoxyethoxy)propanamide
CID 119617079
N-(2-amino-1-cyclohexylethyl)-2-(dimethylamino)-3-methylbutanamide;dihydrochloride
CID 119590156
N-(2-amino-1-cyclopropylethyl)-2-[(4-bromophenyl)sulfonyl-methylamino]acetamide;hydrochloride
CID 119616334

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclopropylethyl)-N',N'-dimethylpropanediamide;hydrochloride?
The IUPAC name of N-(2-amino-1-cyclopropylethyl)-N',N'-dimethylpropanediamide;hydrochloride (CID 119613235) is N-(2-amino-1-cyclopropylethyl)-N',N'-dimethylpropanediamide;hydrochloride.
What is the SMILES notation for N-(2-amino-1-cyclopropylethyl)-N',N'-dimethylpropanediamide;hydrochloride?
The canonical SMILES for N-(2-amino-1-cyclopropylethyl)-N',N'-dimethylpropanediamide;hydrochloride is CN(C)C(=O)CC(=O)NC(CN)C1CC1.Cl.
What is the InChIKey of N-(2-amino-1-cyclopropylethyl)-N',N'-dimethylpropanediamide;hydrochloride?
The InChIKey is DPSHNVWQLGMMQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2.ClH/c1-13(2)10(15)5-9(14)12-8(6-11)7-3-4-7;/h7-8H,3-6,11H2,1-2H3,(H,12,14);1H.
What are the key properties of N-(2-amino-1-cyclopropylethyl)-N',N'-dimethylpropanediamide;hydrochloride?
N-(2-amino-1-cyclopropylethyl)-N',N'-dimethylpropanediamide;hydrochloride has a molecular weight of 249.74 g/mol, XLogP of -0.26, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclopropylethyl)-N',N'-dimethylpropanediamide;hydrochloride is sourced from PubChem (CID 119613235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).