2-(cyclopropanecarbonylamino)acetate

C6H8NO3- — CID 6997226

IUPAC2-(cyclopropanecarbonylamino)acetate
SMILESO=C([O-])CNC(=O)C1CC1
InChIInChI=1S/C6H9NO3/c8-5(9)3-7-6(10)4-1-2-4/h4H,1-3H2,(H,7,10)(H,8,9)/p-1
InChIKeyNDLLIOPAEOBFKZ-UHFFFAOYSA-M
MW142.13 g/mol
LogP-1.74
Rot. Bonds3

About 2-(cyclopropanecarbonylamino)acetate

2-(cyclopropanecarbonylamino)acetate (PubChem CID 6997226) has the molecular formula C6H8NO3- and a molecular weight of 142.13 g/mol. Its IUPAC name is 2-(cyclopropanecarbonylamino)acetate.

Molecular Properties

Compound Name2-(cyclopropanecarbonylamino)acetate
PubChem CID6997226
Molecular FormulaC6H8NO3-
Molecular Weight142.13 g/mol
Exact Mass142.05
IUPAC Name2-(cyclopropanecarbonylamino)acetate
SMILESO=C([O-])CNC(=O)C1CC1
InChIInChI=1S/C6H9NO3/c8-5(9)3-7-6(10)4-1-2-4/h4H,1-3H2,(H,7,10)(H,8,9)/p-1
InChIKeyNDLLIOPAEOBFKZ-UHFFFAOYSA-M
XLogP-1.74
TPSA69.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.13
LogP ≤ 5-1.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(cyclopropylamino)-2-oxoethyl]cyclopropanecarboxamide
CID 60668703
1-N,4-N-bis(3-methyl-2-oxobutyl)cyclohexane-1,4-dicarboxamide
CID 59440307
2-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]acetate
CID 11902929
4-(methylamino)-N-(2-oxopropyl)cyclohexane-1-carboxamide
CID 122579173
ethyl 2-(cyclopropanecarbonylamino)acetate
CID 5228151
N-(2-oxopropyl)cycloheptanecarboxamide
CID 64996887
N-(2-bromoprop-2-enyl)-4-methylcyclohexane-1-carboxamide
CID 115647439
N-(2-methylprop-2-enyl)cyclopentanecarboxamide
CID 91695769
N-oxidocyclopropanecarboxamide
CID 15413548
N-(2-amino-2-sulfanylideneethyl)cyclooctanecarboxamide
CID 65018324
N-(cyclobutylmethyl)cyclopropanecarboxamide
CID 60757387
N-(3,3-difluoro-2-oxopropyl)-4-methylcyclohexane-1-carboxamide
CID 153456408

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropanecarbonylamino)acetate?
The IUPAC name of 2-(cyclopropanecarbonylamino)acetate (CID 6997226) is 2-(cyclopropanecarbonylamino)acetate.
What is the SMILES notation for 2-(cyclopropanecarbonylamino)acetate?
The canonical SMILES for 2-(cyclopropanecarbonylamino)acetate is O=C([O-])CNC(=O)C1CC1.
What is the InChIKey of 2-(cyclopropanecarbonylamino)acetate?
The InChIKey is NDLLIOPAEOBFKZ-UHFFFAOYSA-M. The full InChI is InChI=1S/C6H9NO3/c8-5(9)3-7-6(10)4-1-2-4/h4H,1-3H2,(H,7,10)(H,8,9)/p-1.
What are the key properties of 2-(cyclopropanecarbonylamino)acetate?
2-(cyclopropanecarbonylamino)acetate has a molecular weight of 142.13 g/mol, XLogP of -1.74, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropanecarbonylamino)acetate is sourced from PubChem (CID 6997226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).