methyl 2-cyclopropyl-2-(cyclopropylamino)acetate

C9H15NO2 — CID 61310174

IUPACmethyl 2-cyclopropyl-2-(cyclopropylamino)acetate
SMILESCOC(=O)C(NC1CC1)C1CC1
InChIInChI=1S/C9H15NO2/c1-12-9(11)8(6-2-3-6)10-7-4-5-7/h6-8,10H,2-5H2,1H3
InChIKeyOYKZTWJWASGMOR-UHFFFAOYSA-N
MW169.22 g/mol
LogP0.69
Rot. Bonds4

About methyl 2-cyclopropyl-2-(cyclopropylamino)acetate

methyl 2-cyclopropyl-2-(cyclopropylamino)acetate (PubChem CID 61310174) has the molecular formula C9H15NO2 and a molecular weight of 169.22 g/mol. Its IUPAC name is methyl 2-cyclopropyl-2-(cyclopropylamino)acetate.

Molecular Properties

Compound Namemethyl 2-cyclopropyl-2-(cyclopropylamino)acetate
PubChem CID61310174
Molecular FormulaC9H15NO2
Molecular Weight169.22 g/mol
Exact Mass169.11
IUPAC Namemethyl 2-cyclopropyl-2-(cyclopropylamino)acetate
SMILESCOC(=O)C(NC1CC1)C1CC1
InChIInChI=1S/C9H15NO2/c1-12-9(11)8(6-2-3-6)10-7-4-5-7/h6-8,10H,2-5H2,1H3
InChIKeyOYKZTWJWASGMOR-UHFFFAOYSA-N
XLogP0.69
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.22
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 2-cyclopropyl-2-[(1,1-dioxothian-4-yl)amino]acetate
CID 103239258
methyl 2-cyclopropyl-2-(oxetan-3-ylamino)acetate
CID 103256848
methyl 2-cyclopropyl-2-[(2,2-dimethylcyclopropyl)amino]acetate
CID 103244098
methyl 2-cyclopropyl-2-(2,3-dihydro-1H-inden-2-ylamino)acetate
CID 104693831
methyl 2-acetamido-2-cyclopropylacetate
CID 121215489
ethyl 2-(cyclopentylamino)-2-cyclopropylacetate
CID 61310564
methyl 2-(4-hydroxycyclohexyl)-2-(methylamino)acetate
CID 58137906
2-cyclopropyl-2-[(4-propan-2-ylcyclohexyl)amino]acetic acid
CID 65061416
methyl (2R)-2-cyclopropyl-2-[[(3R)-1-methyl-2-oxopyrrolidin-3-yl]amino]acetate
CID 99777253
methyl 2-cyclopropyl-2-[(3-ethyl-2-methylcyclopentyl)amino]acetate
CID 103254073
methyl 2-cyclopropyl-2-[[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]amino]acetate
CID 107853970
methyl 2-cyclopropyl-2-(2-methylpropoxyamino)acetate
CID 103261569

Frequently Asked Questions

What is the IUPAC name of methyl 2-cyclopropyl-2-(cyclopropylamino)acetate?
The IUPAC name of methyl 2-cyclopropyl-2-(cyclopropylamino)acetate (CID 61310174) is methyl 2-cyclopropyl-2-(cyclopropylamino)acetate.
What is the SMILES notation for methyl 2-cyclopropyl-2-(cyclopropylamino)acetate?
The canonical SMILES for methyl 2-cyclopropyl-2-(cyclopropylamino)acetate is COC(=O)C(NC1CC1)C1CC1.
What is the InChIKey of methyl 2-cyclopropyl-2-(cyclopropylamino)acetate?
The InChIKey is OYKZTWJWASGMOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO2/c1-12-9(11)8(6-2-3-6)10-7-4-5-7/h6-8,10H,2-5H2,1H3.
What are the key properties of methyl 2-cyclopropyl-2-(cyclopropylamino)acetate?
methyl 2-cyclopropyl-2-(cyclopropylamino)acetate has a molecular weight of 169.22 g/mol, XLogP of 0.69, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-cyclopropyl-2-(cyclopropylamino)acetate is sourced from PubChem (CID 61310174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).