2-[cyclopropylmethyl-[[2-(methylamino)-2-oxoethyl]carbamoyl]amino]acetic acid

C10H17N3O4 — CID 43656109

IUPAC2-[cyclopropylmethyl-[[2-(methylamino)-2-oxoethyl]carbamoyl]amino]acetic acid
SMILESCNC(=O)CNC(=O)N(CC(=O)O)CC1CC1
InChIInChI=1S/C10H17N3O4/c1-11-8(14)4-12-10(17)13(6-9(15)16)5-7-2-3-7/h7H,2-6H2,1H3,(H,11,14)(H,12,17)(H,15,16)
InChIKeyUAVCMQNGFMSYEN-UHFFFAOYSA-N
MW243.26 g/mol
LogP-0.76
Rot. Bonds6

About 2-[cyclopropylmethyl-[[2-(methylamino)-2-oxoethyl]carbamoyl]amino]acetic acid

2-[cyclopropylmethyl-[[2-(methylamino)-2-oxoethyl]carbamoyl]amino]acetic acid (PubChem CID 43656109) has the molecular formula C10H17N3O4 and a molecular weight of 243.26 g/mol. Its IUPAC name is 2-[cyclopropylmethyl-[[2-(methylamino)-2-oxoethyl]carbamoyl]amino]acetic acid.

Molecular Properties

Compound Name2-[cyclopropylmethyl-[[2-(methylamino)-2-oxoethyl]carbamoyl]amino]acetic acid
PubChem CID43656109
Molecular FormulaC10H17N3O4
Molecular Weight243.26 g/mol
Exact Mass243.12
IUPAC Name2-[cyclopropylmethyl-[[2-(methylamino)-2-oxoethyl]carbamoyl]amino]acetic acid
SMILESCNC(=O)CNC(=O)N(CC(=O)O)CC1CC1
InChIInChI=1S/C10H17N3O4/c1-11-8(14)4-12-10(17)13(6-9(15)16)5-7-2-3-7/h7H,2-6H2,1H3,(H,11,14)(H,12,17)(H,15,16)
InChIKeyUAVCMQNGFMSYEN-UHFFFAOYSA-N
XLogP-0.76
TPSA98.74 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.26
LogP ≤ 5-0.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-[cyclopropylmethyl-[[2-(methylamino)-2-oxoethyl]carbamoyl]amino]acetic acid with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropylmethyl-[[2-(methylamino)-2-oxoethyl]carbamoyl]amino]acetic acid?
The IUPAC name of 2-[cyclopropylmethyl-[[2-(methylamino)-2-oxoethyl]carbamoyl]amino]acetic acid (CID 43656109) is 2-[cyclopropylmethyl-[[2-(methylamino)-2-oxoethyl]carbamoyl]amino]acetic acid.
What is the SMILES notation for 2-[cyclopropylmethyl-[[2-(methylamino)-2-oxoethyl]carbamoyl]amino]acetic acid?
The canonical SMILES for 2-[cyclopropylmethyl-[[2-(methylamino)-2-oxoethyl]carbamoyl]amino]acetic acid is CNC(=O)CNC(=O)N(CC(=O)O)CC1CC1.
What is the InChIKey of 2-[cyclopropylmethyl-[[2-(methylamino)-2-oxoethyl]carbamoyl]amino]acetic acid?
The InChIKey is UAVCMQNGFMSYEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O4/c1-11-8(14)4-12-10(17)13(6-9(15)16)5-7-2-3-7/h7H,2-6H2,1H3,(H,11,14)(H,12,17)(H,15,16).
What are the key properties of 2-[cyclopropylmethyl-[[2-(methylamino)-2-oxoethyl]carbamoyl]amino]acetic acid?
2-[cyclopropylmethyl-[[2-(methylamino)-2-oxoethyl]carbamoyl]amino]acetic acid has a molecular weight of 243.26 g/mol, XLogP of -0.76, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropylmethyl-[[2-(methylamino)-2-oxoethyl]carbamoyl]amino]acetic acid is sourced from PubChem (CID 43656109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).