methyl 2-amino-2-methyl-3-pyridin-2-ylpropanoate;dihydrochloride

C10H16Cl2N2O2 — CID 155858567

IUPACmethyl 2-amino-2-methyl-3-pyridin-2-ylpropanoate;dihydrochloride
SMILESCOC(=O)C(C)(N)Cc1ccccn1.Cl.Cl
InChIInChI=1S/C10H14N2O2.2ClH/c1-10(11,9(13)14-2)7-8-5-3-4-6-12-8;;/h3-6H,7,11H2,1-2H3;2*1H
InChIKeyGPZAJDLDTIEPNJ-UHFFFAOYSA-N
MW267.16 g/mol
LogP1.36
Rot. Bonds3

About methyl 2-amino-2-methyl-3-pyridin-2-ylpropanoate;dihydrochloride

methyl 2-amino-2-methyl-3-pyridin-2-ylpropanoate;dihydrochloride (PubChem CID 155858567) has the molecular formula C10H16Cl2N2O2 and a molecular weight of 267.16 g/mol. Its IUPAC name is methyl 2-amino-2-methyl-3-pyridin-2-ylpropanoate;dihydrochloride.

Molecular Properties

Compound Namemethyl 2-amino-2-methyl-3-pyridin-2-ylpropanoate;dihydrochloride
PubChem CID155858567
Molecular FormulaC10H16Cl2N2O2
Molecular Weight267.16 g/mol
Exact Mass266.06
IUPAC Namemethyl 2-amino-2-methyl-3-pyridin-2-ylpropanoate;dihydrochloride
SMILESCOC(=O)C(C)(N)Cc1ccccn1.Cl.Cl
InChIInChI=1S/C10H14N2O2.2ClH/c1-10(11,9(13)14-2)7-8-5-3-4-6-12-8;;/h3-6H,7,11H2,1-2H3;2*1H
InChIKeyGPZAJDLDTIEPNJ-UHFFFAOYSA-N
XLogP1.36
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.16
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(3-Methylpyridin-2-yl)propanoic acid
CID 28924889
3-(5-Ethyl-2-pyridinyl)propanoic acid
CID 411803
3-Pyridin-2-ylalanine
CID 2761499
3-Pyridin-2-yl-L-alanine
CID 4210406
3-(2-Pyridyl)-D-alanine
CID 7019768
methyl (2R)-2-[[9-(hydroxyamino)-9-oxononanoyl]amino]-3-pyridin-2-ylpropanoate
CID 25225123
methyl (2S)-2-[[8-(hydroxyamino)-8-oxooctanoyl]amino]-3-pyridin-2-ylpropanoate
CID 56943025
methyl (2S)-2-[[9-(hydroxyamino)-9-oxononanoyl]amino]-3-pyridin-2-ylpropanoate
CID 73352206
Ethyl 3-(4-carbamothioyl-2-pyridinyl)propanoate
CID 145991676
methyl (2R)-2-[[8-(hydroxyamino)-8-oxooctanoyl]amino]-3-pyridin-2-ylpropanoate
CID 162656873
Ethyl 5-amino-2-pyridinepropanoate
CID 23349309
Methyl 3-amino-3-(pyridin-2-yl)propanoate dihydrochloride
CID 42614494

Frequently Asked Questions

What is the IUPAC name of methyl 2-amino-2-methyl-3-pyridin-2-ylpropanoate;dihydrochloride?
The IUPAC name of methyl 2-amino-2-methyl-3-pyridin-2-ylpropanoate;dihydrochloride (CID 155858567) is methyl 2-amino-2-methyl-3-pyridin-2-ylpropanoate;dihydrochloride.
What is the SMILES notation for methyl 2-amino-2-methyl-3-pyridin-2-ylpropanoate;dihydrochloride?
The canonical SMILES for methyl 2-amino-2-methyl-3-pyridin-2-ylpropanoate;dihydrochloride is COC(=O)C(C)(N)Cc1ccccn1.Cl.Cl.
What is the InChIKey of methyl 2-amino-2-methyl-3-pyridin-2-ylpropanoate;dihydrochloride?
The InChIKey is GPZAJDLDTIEPNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2.2ClH/c1-10(11,9(13)14-2)7-8-5-3-4-6-12-8;;/h3-6H,7,11H2,1-2H3;2*1H.
What are the key properties of methyl 2-amino-2-methyl-3-pyridin-2-ylpropanoate;dihydrochloride?
methyl 2-amino-2-methyl-3-pyridin-2-ylpropanoate;dihydrochloride has a molecular weight of 267.16 g/mol, XLogP of 1.36, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-amino-2-methyl-3-pyridin-2-ylpropanoate;dihydrochloride is sourced from PubChem (CID 155858567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).