methyl 2-[[2-(3-methyl-2-pyridinyl)acetyl]-propan-2-ylamino]acetate

C14H20N2O3 — CID 107148632

IUPACmethyl 2-[[2-(3-methyl-2-pyridinyl)acetyl]-propan-2-ylamino]acetate
SMILESCOC(=O)CN(C(=O)Cc1ncccc1C)C(C)C
InChIInChI=1S/C14H20N2O3/c1-10(2)16(9-14(18)19-4)13(17)8-12-11(3)6-5-7-15-12/h5-7,10H,8-9H2,1-4H3
InChIKeyOSULDVGRWRUBPP-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.34
Rot. Bonds5

About methyl 2-[[2-(3-methyl-2-pyridinyl)acetyl]-propan-2-ylamino]acetate

methyl 2-[[2-(3-methyl-2-pyridinyl)acetyl]-propan-2-ylamino]acetate (PubChem CID 107148632) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is methyl 2-[[2-(3-methyl-2-pyridinyl)acetyl]-propan-2-ylamino]acetate.

Molecular Properties

Compound Namemethyl 2-[[2-(3-methyl-2-pyridinyl)acetyl]-propan-2-ylamino]acetate
PubChem CID107148632
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Namemethyl 2-[[2-(3-methyl-2-pyridinyl)acetyl]-propan-2-ylamino]acetate
SMILESCOC(=O)CN(C(=O)Cc1ncccc1C)C(C)C
InChIInChI=1S/C14H20N2O3/c1-10(2)16(9-14(18)19-4)13(17)8-12-11(3)6-5-7-15-12/h5-7,10H,8-9H2,1-4H3
InChIKeyOSULDVGRWRUBPP-UHFFFAOYSA-N
XLogP1.34
TPSA59.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze methyl 2-[[2-(3-methyl-2-pyridinyl)acetyl]-propan-2-ylamino]acetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methyl 2-(3-methyl-2-pyridinyl)acetate
CID 59570556
methyl 2-[cyclopentyl-[2-(3-methyl-2-pyridinyl)acetyl]amino]acetate
CID 107148643
ethyl 2-[(3-methyl-2-pyridinyl)methyl-propan-2-ylamino]acetate
CID 112550243
ethyl 2-[[2-(2-methylphenyl)acetyl]-propan-2-ylamino]acetate
CID 61021189
methyl 2-[[2-(4-phenylphenyl)acetyl]-propan-2-ylamino]acetate
CID 78878003
methyl 2-[propan-2-yl-[2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetyl]amino]acetate
CID 78878085
methyl 2-[[2-[4-(2-methylpropyl)phenyl]acetyl]-propan-2-ylamino]acetate
CID 78884649
methyl 2-[[2-(3,4-dichlorophenyl)acetyl]-propan-2-ylamino]acetate
CID 60766581
3-[methyl-[2-(3-methyl-2-pyridinyl)acetyl]amino]propanoic acid
CID 107147133
ethyl 2-[[2-(aminomethyl)-3-pyridinyl]methyl-propan-2-ylamino]acetate
CID 63383170
1,1,1-trifluoro-3-(3-methyl-2-pyridinyl)propan-2-one
CID 15357183
N-methyl-2-(3-methyl-2-pyridinyl)acetamide
CID 13400651

Frequently Asked Questions

What is the IUPAC name of methyl 2-[[2-(3-methyl-2-pyridinyl)acetyl]-propan-2-ylamino]acetate?
The IUPAC name of methyl 2-[[2-(3-methyl-2-pyridinyl)acetyl]-propan-2-ylamino]acetate (CID 107148632) is methyl 2-[[2-(3-methyl-2-pyridinyl)acetyl]-propan-2-ylamino]acetate.
What is the SMILES notation for methyl 2-[[2-(3-methyl-2-pyridinyl)acetyl]-propan-2-ylamino]acetate?
The canonical SMILES for methyl 2-[[2-(3-methyl-2-pyridinyl)acetyl]-propan-2-ylamino]acetate is COC(=O)CN(C(=O)Cc1ncccc1C)C(C)C.
What is the InChIKey of methyl 2-[[2-(3-methyl-2-pyridinyl)acetyl]-propan-2-ylamino]acetate?
The InChIKey is OSULDVGRWRUBPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-10(2)16(9-14(18)19-4)13(17)8-12-11(3)6-5-7-15-12/h5-7,10H,8-9H2,1-4H3.
What are the key properties of methyl 2-[[2-(3-methyl-2-pyridinyl)acetyl]-propan-2-ylamino]acetate?
methyl 2-[[2-(3-methyl-2-pyridinyl)acetyl]-propan-2-ylamino]acetate has a molecular weight of 264.32 g/mol, XLogP of 1.34, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[[2-(3-methyl-2-pyridinyl)acetyl]-propan-2-ylamino]acetate is sourced from PubChem (CID 107148632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).