3-amino-N,N-bis(2-methylpropyl)propanamide;hydrochloride

C11H25ClN2O — CID 119261436

IUPAC3-amino-N,N-bis(2-methylpropyl)propanamide;hydrochloride
SMILESCC(C)CN(CC(C)C)C(=O)CCN.Cl
InChIInChI=1S/C11H24N2O.ClH/c1-9(2)7-13(8-10(3)4)11(14)5-6-12;/h9-10H,5-8,12H2,1-4H3;1H
InChIKeyIRXCGYZDLQLTMU-UHFFFAOYSA-N
MW236.79 g/mol
LogP1.90
Rot. Bonds6

About 3-amino-N,N-bis(2-methylpropyl)propanamide;hydrochloride

3-amino-N,N-bis(2-methylpropyl)propanamide;hydrochloride (PubChem CID 119261436) has the molecular formula C11H25ClN2O and a molecular weight of 236.79 g/mol. Its IUPAC name is 3-amino-N,N-bis(2-methylpropyl)propanamide;hydrochloride.

Molecular Properties

Compound Name3-amino-N,N-bis(2-methylpropyl)propanamide;hydrochloride
PubChem CID119261436
Molecular FormulaC11H25ClN2O
Molecular Weight236.79 g/mol
Exact Mass236.17
IUPAC Name3-amino-N,N-bis(2-methylpropyl)propanamide;hydrochloride
SMILESCC(C)CN(CC(C)C)C(=O)CCN.Cl
InChIInChI=1S/C11H24N2O.ClH/c1-9(2)7-13(8-10(3)4)11(14)5-6-12;/h9-10H,5-8,12H2,1-4H3;1H
InChIKeyIRXCGYZDLQLTMU-UHFFFAOYSA-N
XLogP1.90
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.79
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)propanamide
CID 60947544
ethyl 2-[3-aminopropanoyl(2-methylpropyl)amino]acetate
CID 60947748
3-amino-N-[(2-chlorophenyl)methyl]-N-(2-methylpropyl)propanamide
CID 39367425
2-amino-N-(2-hydroxypropyl)-N-(2-methylpropyl)acetamide
CID 170614362
4-amino-N-[2-(diethylamino)ethyl]-N-(2-methylpropyl)butanamide
CID 54871197
N,N-bis(2-aminoethyl)-13-methyltetradecanamide;dihydrochloride
CID 11188780
N-(aminomethyl)-3-methyl-N-(2-methylpropyl)butanamide
CID 144977230
[3-aminopropanoyl(phosphonomethyl)amino]methylphosphonic acid
CID 140554532
3-amino-N-methyl-N-propan-2-ylpropanamide
CID 16783725
3-amino-N-butan-2-yl-N-ethylpropanamide
CID 43274458
N,N,N',N'-tetrakis(2-methylpropyl)oxamide
CID 4523531
3-[[2-[bis(2-methylpropyl)amino]-2-oxoethyl]-methylamino]propanoic acid;hydrochloride
CID 119911794

Frequently Asked Questions

What is the IUPAC name of 3-amino-N,N-bis(2-methylpropyl)propanamide;hydrochloride?
The IUPAC name of 3-amino-N,N-bis(2-methylpropyl)propanamide;hydrochloride (CID 119261436) is 3-amino-N,N-bis(2-methylpropyl)propanamide;hydrochloride.
What is the SMILES notation for 3-amino-N,N-bis(2-methylpropyl)propanamide;hydrochloride?
The canonical SMILES for 3-amino-N,N-bis(2-methylpropyl)propanamide;hydrochloride is CC(C)CN(CC(C)C)C(=O)CCN.Cl.
What is the InChIKey of 3-amino-N,N-bis(2-methylpropyl)propanamide;hydrochloride?
The InChIKey is IRXCGYZDLQLTMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O.ClH/c1-9(2)7-13(8-10(3)4)11(14)5-6-12;/h9-10H,5-8,12H2,1-4H3;1H.
What are the key properties of 3-amino-N,N-bis(2-methylpropyl)propanamide;hydrochloride?
3-amino-N,N-bis(2-methylpropyl)propanamide;hydrochloride has a molecular weight of 236.79 g/mol, XLogP of 1.90, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N,N-bis(2-methylpropyl)propanamide;hydrochloride is sourced from PubChem (CID 119261436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).