3-amino-N,2-dimethyl-N-(oxolan-3-yl)butanamide;hydrochloride

C10H21ClN2O2 — CID 120500471

IUPAC3-amino-N,2-dimethyl-N-(oxolan-3-yl)butanamide;hydrochloride
SMILESCC(N)C(C)C(=O)N(C)C1CCOC1.Cl
InChIInChI=1S/C10H20N2O2.ClH/c1-7(8(2)11)10(13)12(3)9-4-5-14-6-9;/h7-9H,4-6,11H2,1-3H3;1H
InChIKeyIJJOJUWXUBKYJO-UHFFFAOYSA-N
MW236.74 g/mol
LogP0.64
Rot. Bonds3

About 3-amino-N,2-dimethyl-N-(oxolan-3-yl)butanamide;hydrochloride

3-amino-N,2-dimethyl-N-(oxolan-3-yl)butanamide;hydrochloride (PubChem CID 120500471) has the molecular formula C10H21ClN2O2 and a molecular weight of 236.74 g/mol. Its IUPAC name is 3-amino-N,2-dimethyl-N-(oxolan-3-yl)butanamide;hydrochloride.

Molecular Properties

Compound Name3-amino-N,2-dimethyl-N-(oxolan-3-yl)butanamide;hydrochloride
PubChem CID120500471
Molecular FormulaC10H21ClN2O2
Molecular Weight236.74 g/mol
Exact Mass236.13
IUPAC Name3-amino-N,2-dimethyl-N-(oxolan-3-yl)butanamide;hydrochloride
SMILESCC(N)C(C)C(=O)N(C)C1CCOC1.Cl
InChIInChI=1S/C10H20N2O2.ClH/c1-7(8(2)11)10(13)12(3)9-4-5-14-6-9;/h7-9H,4-6,11H2,1-3H3;1H
InChIKeyIJJOJUWXUBKYJO-UHFFFAOYSA-N
XLogP0.64
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.74
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-amino-N,3-dimethyl-N-(oxolan-3-yl)butanamide
CID 82738595
3-amino-3-hydroxyimino-N,2-dimethyl-N-(oxolan-3-yl)propanamide
CID 82748788
2-amino-N-methyl-2-(4-methylphenyl)-N-(oxolan-3-yl)acetamide
CID 114172118
2-(N'-hydroxycarbamimidoyl)-N-methyl-N-(oxolan-3-yl)butanamide
CID 82749463
(2S)-3-methyl-2-[[methyl(oxolan-3-yl)carbamoyl]amino]butanoic acid
CID 82742598
2-amino-1-methyl-1-(oxolan-3-yl)guanidine
CID 82740357
3-ethyl-1-methyl-1-(oxolan-3-yl)urea
CID 115616986
3-amino-N-methyl-N-(oxolan-3-yl)cyclohexane-1-carboxamide;hydrochloride
CID 119775453
3-amino-N-methyl-N-(oxolan-3-yl)cyclopentane-1-carboxamide
CID 81489575
6-amino-N,4-dimethyl-N-(oxolan-3-yl)hexanamide
CID 82738778
2-amino-N-methyl-N-(oxolan-3-yl)cycloheptane-1-carboxamide
CID 82738125
2-methyl-1-[methyl(oxolan-3-yl)carbamoyl]pyrrolidine-3-carboxylic acid
CID 82748744

Frequently Asked Questions

What is the IUPAC name of 3-amino-N,2-dimethyl-N-(oxolan-3-yl)butanamide;hydrochloride?
The IUPAC name of 3-amino-N,2-dimethyl-N-(oxolan-3-yl)butanamide;hydrochloride (CID 120500471) is 3-amino-N,2-dimethyl-N-(oxolan-3-yl)butanamide;hydrochloride.
What is the SMILES notation for 3-amino-N,2-dimethyl-N-(oxolan-3-yl)butanamide;hydrochloride?
The canonical SMILES for 3-amino-N,2-dimethyl-N-(oxolan-3-yl)butanamide;hydrochloride is CC(N)C(C)C(=O)N(C)C1CCOC1.Cl.
What is the InChIKey of 3-amino-N,2-dimethyl-N-(oxolan-3-yl)butanamide;hydrochloride?
The InChIKey is IJJOJUWXUBKYJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2.ClH/c1-7(8(2)11)10(13)12(3)9-4-5-14-6-9;/h7-9H,4-6,11H2,1-3H3;1H.
What are the key properties of 3-amino-N,2-dimethyl-N-(oxolan-3-yl)butanamide;hydrochloride?
3-amino-N,2-dimethyl-N-(oxolan-3-yl)butanamide;hydrochloride has a molecular weight of 236.74 g/mol, XLogP of 0.64, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N,2-dimethyl-N-(oxolan-3-yl)butanamide;hydrochloride is sourced from PubChem (CID 120500471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).