2-amino-N-methyl-N-(oxolan-3-ylmethyl)pentanamide;hydrochloride

C11H23ClN2O2 — CID 119341303

IUPAC2-amino-N-methyl-N-(oxolan-3-ylmethyl)pentanamide;hydrochloride
SMILESCCCC(N)C(=O)N(C)CC1CCOC1.Cl
InChIInChI=1S/C11H22N2O2.ClH/c1-3-4-10(12)11(14)13(2)7-9-5-6-15-8-9;/h9-10H,3-8,12H2,1-2H3;1H
InChIKeySOEWNOCWGIHXJH-UHFFFAOYSA-N
MW250.77 g/mol
LogP1.03
Rot. Bonds5

About 2-amino-N-methyl-N-(oxolan-3-ylmethyl)pentanamide;hydrochloride

2-amino-N-methyl-N-(oxolan-3-ylmethyl)pentanamide;hydrochloride (PubChem CID 119341303) has the molecular formula C11H23ClN2O2 and a molecular weight of 250.77 g/mol. Its IUPAC name is 2-amino-N-methyl-N-(oxolan-3-ylmethyl)pentanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-methyl-N-(oxolan-3-ylmethyl)pentanamide;hydrochloride
PubChem CID119341303
Molecular FormulaC11H23ClN2O2
Molecular Weight250.77 g/mol
Exact Mass250.14
IUPAC Name2-amino-N-methyl-N-(oxolan-3-ylmethyl)pentanamide;hydrochloride
SMILESCCCC(N)C(=O)N(C)CC1CCOC1.Cl
InChIInChI=1S/C11H22N2O2.ClH/c1-3-4-10(12)11(14)13(2)7-9-5-6-15-8-9;/h9-10H,3-8,12H2,1-2H3;1H
InChIKeySOEWNOCWGIHXJH-UHFFFAOYSA-N
XLogP1.03
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.77
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-amino-N-(cyclobutylmethyl)-N-methylpentanamide
CID 103796269
(2S)-2-amino-N-(cyclohexylmethyl)-N-methylpentanamide
CID 107568999
2-amino-N-ethyl-N-(oxolan-3-ylmethyl)hexanamide
CID 54874277
(2S)-2-amino-N-methyl-N-(oxolan-2-ylmethyl)pentanamide
CID 107569428
N-methyl-N-(oxolan-3-ylmethyl)acetamide
CID 129016783
(2S)-2-amino-N-ethyl-N-(oxolan-3-ylmethyl)propanamide
CID 61148831
(2R)-2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methylpentanamide
CID 107569736
1,3-dimethyl-1-[[(3S)-oxolan-3-yl]methyl]urea
CID 163816588
2-amino-3-(4-hydroxyphenyl)-N-methyl-N-(oxan-3-ylmethyl)propanamide
CID 76951643
(2R)-2-amino-N-ethyl-N-methylpentanamide
CID 93255557
3-amino-N-ethyl-2-methyl-N-(oxolan-3-ylmethyl)propanamide
CID 62668913
(2S)-2-amino-N-ethyl-N-(oxolan-3-ylmethyl)-4-phenylbutanamide
CID 104984084

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-methyl-N-(oxolan-3-ylmethyl)pentanamide;hydrochloride?
The IUPAC name of 2-amino-N-methyl-N-(oxolan-3-ylmethyl)pentanamide;hydrochloride (CID 119341303) is 2-amino-N-methyl-N-(oxolan-3-ylmethyl)pentanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-methyl-N-(oxolan-3-ylmethyl)pentanamide;hydrochloride?
The canonical SMILES for 2-amino-N-methyl-N-(oxolan-3-ylmethyl)pentanamide;hydrochloride is CCCC(N)C(=O)N(C)CC1CCOC1.Cl.
What is the InChIKey of 2-amino-N-methyl-N-(oxolan-3-ylmethyl)pentanamide;hydrochloride?
The InChIKey is SOEWNOCWGIHXJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2.ClH/c1-3-4-10(12)11(14)13(2)7-9-5-6-15-8-9;/h9-10H,3-8,12H2,1-2H3;1H.
What are the key properties of 2-amino-N-methyl-N-(oxolan-3-ylmethyl)pentanamide;hydrochloride?
2-amino-N-methyl-N-(oxolan-3-ylmethyl)pentanamide;hydrochloride has a molecular weight of 250.77 g/mol, XLogP of 1.03, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-methyl-N-(oxolan-3-ylmethyl)pentanamide;hydrochloride is sourced from PubChem (CID 119341303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).