methyl 2-[cyclopropyl(methyl)carbamoyl]cyclopropane-1-carboxylate

C10H15NO3 — CID 54557644

IUPACmethyl 2-[cyclopropyl(methyl)carbamoyl]cyclopropane-1-carboxylate
SMILESCOC(=O)C1CC1C(=O)N(C)C1CC1
InChIInChI=1S/C10H15NO3/c1-11(6-3-4-6)9(12)7-5-8(7)10(13)14-2/h6-8H,3-5H2,1-2H3
InChIKeyZOHAAXHVDRPVIB-UHFFFAOYSA-N
MW197.23 g/mol
LogP0.42
Rot. Bonds3

About methyl 2-[cyclopropyl(methyl)carbamoyl]cyclopropane-1-carboxylate

methyl 2-[cyclopropyl(methyl)carbamoyl]cyclopropane-1-carboxylate (PubChem CID 54557644) has the molecular formula C10H15NO3 and a molecular weight of 197.23 g/mol. Its IUPAC name is methyl 2-[cyclopropyl(methyl)carbamoyl]cyclopropane-1-carboxylate.

Molecular Properties

Compound Namemethyl 2-[cyclopropyl(methyl)carbamoyl]cyclopropane-1-carboxylate
PubChem CID54557644
Molecular FormulaC10H15NO3
Molecular Weight197.23 g/mol
Exact Mass197.11
IUPAC Namemethyl 2-[cyclopropyl(methyl)carbamoyl]cyclopropane-1-carboxylate
SMILESCOC(=O)C1CC1C(=O)N(C)C1CC1
InChIInChI=1S/C10H15NO3/c1-11(6-3-4-6)9(12)7-5-8(7)10(13)14-2/h6-8H,3-5H2,1-2H3
InChIKeyZOHAAXHVDRPVIB-UHFFFAOYSA-N
XLogP0.42
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.23
LogP ≤ 50.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

cis-(1S,2R)-2-[cyclopropyl(methyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 93311623
2-[cyclopropyl(methyl)carbamoyl]cyclopropane-1-carboxylate
CID 18434341
cis-methyl (1R,2S)-2-[[4-[[(3R,5S)-1,5-dimethylpyrrolidine-3-carbonyl]amino]cyclohexyl]-methylcarbamoyl]cyclopropane-1-carboxylate
CID 167784509
tetramethyl (1S,2R,4S,5R)-cyclohexane-1,2,4,5-tetracarboxylate
CID 102016488
dimethyl cyclopropane-1,2-dicarboxylate
CID 2724542
2-[cyclobutyl(methyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 115730407
methyl 4-[methoxycarbonyl(methyl)amino]cyclohexane-1-carboxylate
CID 115270421
methyl (2S)-2-carbonochloridoylcyclopropane-1-carboxylate
CID 140893068
methyl 4-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]cyclohexane-1-carboxylate
CID 23062642
methyl 2-methylcyclopentane-1-carboxylate
CID 13435361
methyl 2-[cyclopropyl(methyl)amino]-2-oxoacetate
CID 112616726
cis-methyl (1R,3S)-3-(dimethylamino)cyclopentane-1-carboxylate
CID 99996118

Frequently Asked Questions

What is the IUPAC name of methyl 2-[cyclopropyl(methyl)carbamoyl]cyclopropane-1-carboxylate?
The IUPAC name of methyl 2-[cyclopropyl(methyl)carbamoyl]cyclopropane-1-carboxylate (CID 54557644) is methyl 2-[cyclopropyl(methyl)carbamoyl]cyclopropane-1-carboxylate.
What is the SMILES notation for methyl 2-[cyclopropyl(methyl)carbamoyl]cyclopropane-1-carboxylate?
The canonical SMILES for methyl 2-[cyclopropyl(methyl)carbamoyl]cyclopropane-1-carboxylate is COC(=O)C1CC1C(=O)N(C)C1CC1.
What is the InChIKey of methyl 2-[cyclopropyl(methyl)carbamoyl]cyclopropane-1-carboxylate?
The InChIKey is ZOHAAXHVDRPVIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO3/c1-11(6-3-4-6)9(12)7-5-8(7)10(13)14-2/h6-8H,3-5H2,1-2H3.
What are the key properties of methyl 2-[cyclopropyl(methyl)carbamoyl]cyclopropane-1-carboxylate?
methyl 2-[cyclopropyl(methyl)carbamoyl]cyclopropane-1-carboxylate has a molecular weight of 197.23 g/mol, XLogP of 0.42, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[cyclopropyl(methyl)carbamoyl]cyclopropane-1-carboxylate is sourced from PubChem (CID 54557644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).