2-[cyclopentyl-[2-(cyclopropylamino)acetyl]amino]acetic acid

C12H20N2O3 — CID 61161688

IUPAC2-[cyclopentyl-[2-(cyclopropylamino)acetyl]amino]acetic acid
SMILESO=C(O)CN(C(=O)CNC1CC1)C1CCCC1
InChIInChI=1S/C12H20N2O3/c15-11(7-13-9-5-6-9)14(8-12(16)17)10-3-1-2-4-10/h9-10,13H,1-8H2,(H,16,17)
InChIKeyMAAKYLQASRVVII-UHFFFAOYSA-N
MW240.30 g/mol
LogP0.59
Rot. Bonds6

About 2-[cyclopentyl-[2-(cyclopropylamino)acetyl]amino]acetic acid

2-[cyclopentyl-[2-(cyclopropylamino)acetyl]amino]acetic acid (PubChem CID 61161688) has the molecular formula C12H20N2O3 and a molecular weight of 240.30 g/mol. Its IUPAC name is 2-[cyclopentyl-[2-(cyclopropylamino)acetyl]amino]acetic acid.

Molecular Properties

Compound Name2-[cyclopentyl-[2-(cyclopropylamino)acetyl]amino]acetic acid
PubChem CID61161688
Molecular FormulaC12H20N2O3
Molecular Weight240.30 g/mol
Exact Mass240.15
IUPAC Name2-[cyclopentyl-[2-(cyclopropylamino)acetyl]amino]acetic acid
SMILESO=C(O)CN(C(=O)CNC1CC1)C1CCCC1
InChIInChI=1S/C12H20N2O3/c15-11(7-13-9-5-6-9)14(8-12(16)17)10-3-1-2-4-10/h9-10,13H,1-8H2,(H,16,17)
InChIKeyMAAKYLQASRVVII-UHFFFAOYSA-N
XLogP0.59
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.30
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[cyclopentyl-[2-(cyclopropylmethylamino)acetyl]amino]acetic acid
CID 61162082
2-[(2-cyclohexylacetyl)-cyclopentylamino]acetic acid
CID 60826296
2-[[2-(cyclopropylamino)acetyl]-propan-2-ylamino]acetic acid
CID 61162023
2-[[2-(cyclopentylamino)acetyl]-(2-methylpropyl)amino]acetic acid
CID 55148404
N-benzyl-2-(cyclopentylamino)-N-cyclopropylacetamide
CID 60846421
2-[[2-(1-aminocyclobutyl)acetyl]-cyclopentylamino]acetic acid
CID 79854894
2-(cyclopropylamino)acetic acid
CID 21197388
2-[cyclopentylcarbamoyl(cyclopropyl)amino]acetic acid
CID 61187386
2-(cyclododecylamino)-N,N-dimethylacetamide
CID 43214559
2-[4-cyclohexylbutanoyl(cyclopentyl)amino]acetic acid
CID 60825422
2-[cyclopentyl-(2-phenylacetyl)amino]acetic acid
CID 54926378
[carboxy(cyclohexyl)amino]methyl-cyclohexylcarbamic acid
CID 151845320

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl-[2-(cyclopropylamino)acetyl]amino]acetic acid?
The IUPAC name of 2-[cyclopentyl-[2-(cyclopropylamino)acetyl]amino]acetic acid (CID 61161688) is 2-[cyclopentyl-[2-(cyclopropylamino)acetyl]amino]acetic acid.
What is the SMILES notation for 2-[cyclopentyl-[2-(cyclopropylamino)acetyl]amino]acetic acid?
The canonical SMILES for 2-[cyclopentyl-[2-(cyclopropylamino)acetyl]amino]acetic acid is O=C(O)CN(C(=O)CNC1CC1)C1CCCC1.
What is the InChIKey of 2-[cyclopentyl-[2-(cyclopropylamino)acetyl]amino]acetic acid?
The InChIKey is MAAKYLQASRVVII-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O3/c15-11(7-13-9-5-6-9)14(8-12(16)17)10-3-1-2-4-10/h9-10,13H,1-8H2,(H,16,17).
What are the key properties of 2-[cyclopentyl-[2-(cyclopropylamino)acetyl]amino]acetic acid?
2-[cyclopentyl-[2-(cyclopropylamino)acetyl]amino]acetic acid has a molecular weight of 240.30 g/mol, XLogP of 0.59, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl-[2-(cyclopropylamino)acetyl]amino]acetic acid is sourced from PubChem (CID 61161688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).