N-(3-amino-2,2-dimethylpropyl)-N-methyl-3-(5-methyloxolan-2-yl)propanamide;hydrochloride

C14H29ClN2O2 — CID 119655368

IUPACN-(3-amino-2,2-dimethylpropyl)-N-methyl-3-(5-methyloxolan-2-yl)propanamide;hydrochloride
SMILESCC1CCC(CCC(=O)N(C)CC(C)(C)CN)O1.Cl
InChIInChI=1S/C14H28N2O2.ClH/c1-11-5-6-12(18-11)7-8-13(17)16(4)10-14(2,3)9-15;/h11-12H,5-10,15H2,1-4H3;1H
InChIKeyFFZFHQCTKILXTM-UHFFFAOYSA-N
MW292.85 g/mol
LogP2.20
Rot. Bonds6

About N-(3-amino-2,2-dimethylpropyl)-N-methyl-3-(5-methyloxolan-2-yl)propanamide;hydrochloride

N-(3-amino-2,2-dimethylpropyl)-N-methyl-3-(5-methyloxolan-2-yl)propanamide;hydrochloride (PubChem CID 119655368) has the molecular formula C14H29ClN2O2 and a molecular weight of 292.85 g/mol. Its IUPAC name is N-(3-amino-2,2-dimethylpropyl)-N-methyl-3-(5-methyloxolan-2-yl)propanamide;hydrochloride.

Molecular Properties

Compound NameN-(3-amino-2,2-dimethylpropyl)-N-methyl-3-(5-methyloxolan-2-yl)propanamide;hydrochloride
PubChem CID119655368
Molecular FormulaC14H29ClN2O2
Molecular Weight292.85 g/mol
Exact Mass292.19
IUPAC NameN-(3-amino-2,2-dimethylpropyl)-N-methyl-3-(5-methyloxolan-2-yl)propanamide;hydrochloride
SMILESCC1CCC(CCC(=O)N(C)CC(C)(C)CN)O1.Cl
InChIInChI=1S/C14H28N2O2.ClH/c1-11-5-6-12(18-11)7-8-13(17)16(4)10-14(2,3)9-15;/h11-12H,5-10,15H2,1-4H3;1H
InChIKeyFFZFHQCTKILXTM-UHFFFAOYSA-N
XLogP2.20
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.85
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-amino-2,3-dimethylbutan-2-yl)-3-(5-methyloxolan-2-yl)propanamide
CID 119607721
N-(3-amino-2,2-dimethylpropyl)-N-methyl-2-(oxolan-2-yl)acetamide
CID 79652980
N-(3-amino-2,2-dimethylpropyl)-2-cyclobutyl-N-methylacetamide
CID 103807677
N-(3-amino-2-methylpropyl)-3-(5-methyloxolan-2-yl)propanamide;hydrochloride
CID 119998020
N-methyl-3-[(2R,5S)-5-methyloxolan-2-yl]-N-[(4-nitrophenyl)methyl]propanamide
CID 97218663
N-(3-amino-2,2-dimethylpropyl)-N-methyldodecanamide
CID 79646027
N-(3-amino-2,2-dimethylpropyl)-N-methylnonanamide
CID 79652123
N-(3-amino-2,2-dimethylpropyl)-N-methylhex-5-enamide;dihydrochloride
CID 119656537
2,2-dimethyl-3-[3-[(2S,5S)-5-methyloxolan-2-yl]propanoylamino]propanoic acid
CID 124694239
N-(2-aminoethyl)-3-(5-methyloxolan-2-yl)-N-(2-phenylethyl)propanamide;hydrochloride
CID 120885197
2-methyl-5-[[methyl-[3-[(2R,5S)-5-methyloxolan-2-yl]propanoyl]amino]methyl]furan-3-carboxylic acid
CID 125132347
N-(3-amino-2,2-dimethylpropyl)-N-methylbut-3-enamide
CID 79653171

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2,2-dimethylpropyl)-N-methyl-3-(5-methyloxolan-2-yl)propanamide;hydrochloride?
The IUPAC name of N-(3-amino-2,2-dimethylpropyl)-N-methyl-3-(5-methyloxolan-2-yl)propanamide;hydrochloride (CID 119655368) is N-(3-amino-2,2-dimethylpropyl)-N-methyl-3-(5-methyloxolan-2-yl)propanamide;hydrochloride.
What is the SMILES notation for N-(3-amino-2,2-dimethylpropyl)-N-methyl-3-(5-methyloxolan-2-yl)propanamide;hydrochloride?
The canonical SMILES for N-(3-amino-2,2-dimethylpropyl)-N-methyl-3-(5-methyloxolan-2-yl)propanamide;hydrochloride is CC1CCC(CCC(=O)N(C)CC(C)(C)CN)O1.Cl.
What is the InChIKey of N-(3-amino-2,2-dimethylpropyl)-N-methyl-3-(5-methyloxolan-2-yl)propanamide;hydrochloride?
The InChIKey is FFZFHQCTKILXTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2.ClH/c1-11-5-6-12(18-11)7-8-13(17)16(4)10-14(2,3)9-15;/h11-12H,5-10,15H2,1-4H3;1H.
What are the key properties of N-(3-amino-2,2-dimethylpropyl)-N-methyl-3-(5-methyloxolan-2-yl)propanamide;hydrochloride?
N-(3-amino-2,2-dimethylpropyl)-N-methyl-3-(5-methyloxolan-2-yl)propanamide;hydrochloride has a molecular weight of 292.85 g/mol, XLogP of 2.20, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2,2-dimethylpropyl)-N-methyl-3-(5-methyloxolan-2-yl)propanamide;hydrochloride is sourced from PubChem (CID 119655368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).