5-[[[(2R)-2-aminopropanoyl]amino]methyl]-N,N-dimethyloxolane-2-carboxamide;hydrochloride

C11H22ClN3O3 — CID 120874053

IUPAC5-[[[(2R)-2-aminopropanoyl]amino]methyl]-N,N-dimethyloxolane-2-carboxamide;hydrochloride
SMILESC[C@@H](N)C(=O)NCC1CCC(C(=O)N(C)C)O1.Cl
InChIInChI=1S/C11H21N3O3.ClH/c1-7(12)10(15)13-6-8-4-5-9(17-8)11(16)14(2)3;/h7-9H,4-6,12H2,1-3H3,(H,13,15);1H/t7-,8?,9?;/m1./s1
InChIKeyGZCGMOHQJYNPGQ-CHHXHTNCSA-N
MW279.77 g/mol
LogP-0.49
Rot. Bonds4

About 5-[[[(2R)-2-aminopropanoyl]amino]methyl]-N,N-dimethyloxolane-2-carboxamide;hydrochloride

5-[[[(2R)-2-aminopropanoyl]amino]methyl]-N,N-dimethyloxolane-2-carboxamide;hydrochloride (PubChem CID 120874053) has the molecular formula C11H22ClN3O3 and a molecular weight of 279.77 g/mol. Its IUPAC name is 5-[[[(2R)-2-aminopropanoyl]amino]methyl]-N,N-dimethyloxolane-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name5-[[[(2R)-2-aminopropanoyl]amino]methyl]-N,N-dimethyloxolane-2-carboxamide;hydrochloride
PubChem CID120874053
Molecular FormulaC11H22ClN3O3
Molecular Weight279.77 g/mol
Exact Mass279.13
IUPAC Name5-[[[(2R)-2-aminopropanoyl]amino]methyl]-N,N-dimethyloxolane-2-carboxamide;hydrochloride
SMILESC[C@@H](N)C(=O)NCC1CCC(C(=O)N(C)C)O1.Cl
InChIInChI=1S/C11H21N3O3.ClH/c1-7(12)10(15)13-6-8-4-5-9(17-8)11(16)14(2)3;/h7-9H,4-6,12H2,1-3H3,(H,13,15);1H/t7-,8?,9?;/m1./s1
InChIKeyGZCGMOHQJYNPGQ-CHHXHTNCSA-N
XLogP-0.49
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.77
LogP ≤ 5-0.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-[[[(2R)-2-aminopropanoyl]amino]methyl]-N,N-dimethyloxolane-2-carboxamide;hydrochloride with MolForge

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Related Compounds

5-[(3-aminobutanoylamino)methyl]-N,N-dimethyloxolane-2-carboxamide
CID 120874052
(2R,5R)-5-(aminomethyl)-N,N-dimethyloxolane-2-carboxamide
CID 97050721
5-[[[(2S)-2-amino-4-methylpentanoyl]amino]methyl]oxolane-2-carboxamide
CID 119822338
2-amino-N-(cyclooctylmethyl)propanamide;hydrochloride
CID 119299452
(2S)-2-amino-N-(oxolan-2-ylmethyl)propanamide
CID 61145996
2-amino-N-(oxolan-2-ylmethyl)propanamide
CID 24697469
N,N-dimethyl-5-[(1-thiophen-2-ylethylamino)methyl]oxolane-2-carboxamide
CID 75483143
2-amino-N-(cyclopropylmethyl)propanamide
CID 24690233
N,N-dimethyl-5-[[1-(5-methylthiophen-2-yl)ethylamino]methyl]oxolane-2-carboxamide
CID 75515785
2-amino-N-(cyclohexylmethyl)propanamide
CID 43215382
(2S,5R)-5-[[[2-(2,5-difluorophenyl)acetyl]amino]methyl]-N,N-dimethyloxolane-2-carboxamide
CID 97333491
(2R,5R)-5-[[[2-[benzenesulfonyl(methyl)amino]acetyl]amino]methyl]-N,N-dimethyloxolane-2-carboxamide
CID 97256959

Frequently Asked Questions

What is the IUPAC name of 5-[[[(2R)-2-aminopropanoyl]amino]methyl]-N,N-dimethyloxolane-2-carboxamide;hydrochloride?
The IUPAC name of 5-[[[(2R)-2-aminopropanoyl]amino]methyl]-N,N-dimethyloxolane-2-carboxamide;hydrochloride (CID 120874053) is 5-[[[(2R)-2-aminopropanoyl]amino]methyl]-N,N-dimethyloxolane-2-carboxamide;hydrochloride.
What is the SMILES notation for 5-[[[(2R)-2-aminopropanoyl]amino]methyl]-N,N-dimethyloxolane-2-carboxamide;hydrochloride?
The canonical SMILES for 5-[[[(2R)-2-aminopropanoyl]amino]methyl]-N,N-dimethyloxolane-2-carboxamide;hydrochloride is C[C@@H](N)C(=O)NCC1CCC(C(=O)N(C)C)O1.Cl.
What is the InChIKey of 5-[[[(2R)-2-aminopropanoyl]amino]methyl]-N,N-dimethyloxolane-2-carboxamide;hydrochloride?
The InChIKey is GZCGMOHQJYNPGQ-CHHXHTNCSA-N. The full InChI is InChI=1S/C11H21N3O3.ClH/c1-7(12)10(15)13-6-8-4-5-9(17-8)11(16)14(2)3;/h7-9H,4-6,12H2,1-3H3,(H,13,15);1H/t7-,8?,9?;/m1./s1.
What are the key properties of 5-[[[(2R)-2-aminopropanoyl]amino]methyl]-N,N-dimethyloxolane-2-carboxamide;hydrochloride?
5-[[[(2R)-2-aminopropanoyl]amino]methyl]-N,N-dimethyloxolane-2-carboxamide;hydrochloride has a molecular weight of 279.77 g/mol, XLogP of -0.49, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[[(2R)-2-aminopropanoyl]amino]methyl]-N,N-dimethyloxolane-2-carboxamide;hydrochloride is sourced from PubChem (CID 120874053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).