2-[cyclopropylcarbamoyl(cyclopropylmethyl)amino]acetic acid

C10H16N2O3 — CID 43655769

IUPAC2-[cyclopropylcarbamoyl(cyclopropylmethyl)amino]acetic acid
SMILESO=C(O)CN(CC1CC1)C(=O)NC1CC1
InChIInChI=1S/C10H16N2O3/c13-9(14)6-12(5-7-1-2-7)10(15)11-8-3-4-8/h7-8H,1-6H2,(H,11,15)(H,13,14)
InChIKeySLZXCMSKFCRZRA-UHFFFAOYSA-N
MW212.25 g/mol
LogP0.65
Rot. Bonds5

About 2-[cyclopropylcarbamoyl(cyclopropylmethyl)amino]acetic acid

2-[cyclopropylcarbamoyl(cyclopropylmethyl)amino]acetic acid (PubChem CID 43655769) has the molecular formula C10H16N2O3 and a molecular weight of 212.25 g/mol. Its IUPAC name is 2-[cyclopropylcarbamoyl(cyclopropylmethyl)amino]acetic acid.

Molecular Properties

Compound Name2-[cyclopropylcarbamoyl(cyclopropylmethyl)amino]acetic acid
PubChem CID43655769
Molecular FormulaC10H16N2O3
Molecular Weight212.25 g/mol
Exact Mass212.12
IUPAC Name2-[cyclopropylcarbamoyl(cyclopropylmethyl)amino]acetic acid
SMILESO=C(O)CN(CC1CC1)C(=O)NC1CC1
InChIInChI=1S/C10H16N2O3/c13-9(14)6-12(5-7-1-2-7)10(15)11-8-3-4-8/h7-8H,1-6H2,(H,11,15)(H,13,14)
InChIKeySLZXCMSKFCRZRA-UHFFFAOYSA-N
XLogP0.65
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropylcarbamoyl(cyclopropylmethyl)amino]acetic acid?
The IUPAC name of 2-[cyclopropylcarbamoyl(cyclopropylmethyl)amino]acetic acid (CID 43655769) is 2-[cyclopropylcarbamoyl(cyclopropylmethyl)amino]acetic acid.
What is the SMILES notation for 2-[cyclopropylcarbamoyl(cyclopropylmethyl)amino]acetic acid?
The canonical SMILES for 2-[cyclopropylcarbamoyl(cyclopropylmethyl)amino]acetic acid is O=C(O)CN(CC1CC1)C(=O)NC1CC1.
What is the InChIKey of 2-[cyclopropylcarbamoyl(cyclopropylmethyl)amino]acetic acid?
The InChIKey is SLZXCMSKFCRZRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O3/c13-9(14)6-12(5-7-1-2-7)10(15)11-8-3-4-8/h7-8H,1-6H2,(H,11,15)(H,13,14).
What are the key properties of 2-[cyclopropylcarbamoyl(cyclopropylmethyl)amino]acetic acid?
2-[cyclopropylcarbamoyl(cyclopropylmethyl)amino]acetic acid has a molecular weight of 212.25 g/mol, XLogP of 0.65, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropylcarbamoyl(cyclopropylmethyl)amino]acetic acid is sourced from PubChem (CID 43655769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).