methyl 2-(cyclopropylamino)-2-pyridin-2-ylacetate

C11H14N2O2 — CID 66593106

IUPACmethyl 2-(cyclopropylamino)-2-pyridin-2-ylacetate
SMILESCOC(=O)C(NC1CC1)c1ccccn1
InChIInChI=1S/C11H14N2O2/c1-15-11(14)10(13-8-5-6-8)9-4-2-3-7-12-9/h2-4,7-8,10,13H,5-6H2,1H3
InChIKeyZRVKHLOIICCYRA-UHFFFAOYSA-N
MW206.25 g/mol
LogP1.05
Rot. Bonds4

About methyl 2-(cyclopropylamino)-2-pyridin-2-ylacetate

methyl 2-(cyclopropylamino)-2-pyridin-2-ylacetate (PubChem CID 66593106) has the molecular formula C11H14N2O2 and a molecular weight of 206.25 g/mol. Its IUPAC name is methyl 2-(cyclopropylamino)-2-pyridin-2-ylacetate.

Molecular Properties

Compound Namemethyl 2-(cyclopropylamino)-2-pyridin-2-ylacetate
PubChem CID66593106
Molecular FormulaC11H14N2O2
Molecular Weight206.25 g/mol
Exact Mass206.11
IUPAC Namemethyl 2-(cyclopropylamino)-2-pyridin-2-ylacetate
SMILESCOC(=O)C(NC1CC1)c1ccccn1
InChIInChI=1S/C11H14N2O2/c1-15-11(14)10(13-8-5-6-8)9-4-2-3-7-12-9/h2-4,7-8,10,13H,5-6H2,1H3
InChIKeyZRVKHLOIICCYRA-UHFFFAOYSA-N
XLogP1.05
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-(cyclopropylamino)-2-pyridin-4-ylacetate
CID 116857371
methyl 2-(cyclopropylamino)-2-pyridin-3-ylacetate
CID 60795276
methyl 2-(cyclohexylamino)-2-phenylacetate
CID 3755192
methyl (2R)-2-amino-2-pyridin-2-ylacetate
CID 86316521
methyl (2S)-2-(benzylamino)-2-pyridin-2-ylacetate
CID 101379126
methyl 2-(cyclopropylamino)-2-(4-phenylphenyl)acetate
CID 60796680
methyl 2-methyl-3-pyridin-2-ylbutanoate
CID 102470935
methyl 2-(cyclopropylamino)-2-(2,6-difluorophenyl)acetate
CID 60795655
methyl 2-(cyclopropylamino)-2-(1H-pyrrol-2-yl)acetate
CID 116857352
methyl (2R)-2-[[(1R,2R,4S)-bicyclo[2.2.1]hept-5-ene-2-carbonyl]amino]-2-pyridin-2-ylacetate
CID 98347239
methyl 2-(2-chlorophenyl)-2-(cyclopentylamino)acetate
CID 60727132
methyl 2-(cyclopropylamino)-2-isoquinolin-4-ylacetate
CID 104504264

Frequently Asked Questions

What is the IUPAC name of methyl 2-(cyclopropylamino)-2-pyridin-2-ylacetate?
The IUPAC name of methyl 2-(cyclopropylamino)-2-pyridin-2-ylacetate (CID 66593106) is methyl 2-(cyclopropylamino)-2-pyridin-2-ylacetate.
What is the SMILES notation for methyl 2-(cyclopropylamino)-2-pyridin-2-ylacetate?
The canonical SMILES for methyl 2-(cyclopropylamino)-2-pyridin-2-ylacetate is COC(=O)C(NC1CC1)c1ccccn1.
What is the InChIKey of methyl 2-(cyclopropylamino)-2-pyridin-2-ylacetate?
The InChIKey is ZRVKHLOIICCYRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2/c1-15-11(14)10(13-8-5-6-8)9-4-2-3-7-12-9/h2-4,7-8,10,13H,5-6H2,1H3.
What are the key properties of methyl 2-(cyclopropylamino)-2-pyridin-2-ylacetate?
methyl 2-(cyclopropylamino)-2-pyridin-2-ylacetate has a molecular weight of 206.25 g/mol, XLogP of 1.05, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(cyclopropylamino)-2-pyridin-2-ylacetate is sourced from PubChem (CID 66593106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).