2-[cyclopentyl(cyclopentylmethyl)amino]acetic acid

C13H23NO2 — CID 61342644

IUPAC2-[cyclopentyl(cyclopentylmethyl)amino]acetic acid
SMILESO=C(O)CN(CC1CCCC1)C1CCCC1
InChIInChI=1S/C13H23NO2/c15-13(16)10-14(12-7-3-4-8-12)9-11-5-1-2-6-11/h11-12H,1-10H2,(H,15,16)
InChIKeyIZCBHOWQWYIKQO-UHFFFAOYSA-N
MW225.33 g/mol
LogP2.51
Rot. Bonds5

About 2-[cyclopentyl(cyclopentylmethyl)amino]acetic acid

2-[cyclopentyl(cyclopentylmethyl)amino]acetic acid (PubChem CID 61342644) has the molecular formula C13H23NO2 and a molecular weight of 225.33 g/mol. Its IUPAC name is 2-[cyclopentyl(cyclopentylmethyl)amino]acetic acid.

Molecular Properties

Compound Name2-[cyclopentyl(cyclopentylmethyl)amino]acetic acid
PubChem CID61342644
Molecular FormulaC13H23NO2
Molecular Weight225.33 g/mol
Exact Mass225.17
IUPAC Name2-[cyclopentyl(cyclopentylmethyl)amino]acetic acid
SMILESO=C(O)CN(CC1CCCC1)C1CCCC1
InChIInChI=1S/C13H23NO2/c15-13(16)10-14(12-7-3-4-8-12)9-11-5-1-2-6-11/h11-12H,1-10H2,(H,15,16)
InChIKeyIZCBHOWQWYIKQO-UHFFFAOYSA-N
XLogP2.51
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.33
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[cyclobutylmethyl-(1,1-dioxothiolan-3-yl)amino]acetic acid
CID 65459687
2-[cyclopropylmethyl-(1-propan-2-ylazepan-4-yl)amino]acetic acid
CID 65076862
2-[cyclopentyl(2-methylpropyl)amino]acetic acid
CID 60835237
2-[cyclododecyl(propyl)amino]acetic acid
CID 65064979
2-[cyclopropylmethyl-(3-methylcyclobutyl)amino]acetic acid
CID 103565060
2-[2-aminoethyl(cycloheptyl)amino]acetic acid
CID 117013481
2-[(2-amino-2-oxoethyl)-(cyclobutylmethyl)amino]acetic acid
CID 107440783
2-[cyanomethyl(cyclopentyl)amino]acetic acid
CID 60833018
2-[cyclopropylmethyl-(1-ethylpiperidin-4-yl)amino]acetic acid
CID 65055001
2-[[cyclobutylmethyl(methyl)carbamoyl]-cyclopentylamino]acetic acid
CID 55125772
2-[cyclopropylmethyl-(3,5-dimethylcyclohexyl)amino]acetic acid
CID 64728458
2-[[(E)-but-2-enyl]-cyclopentylamino]acetic acid
CID 60835424

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl(cyclopentylmethyl)amino]acetic acid?
The IUPAC name of 2-[cyclopentyl(cyclopentylmethyl)amino]acetic acid (CID 61342644) is 2-[cyclopentyl(cyclopentylmethyl)amino]acetic acid.
What is the SMILES notation for 2-[cyclopentyl(cyclopentylmethyl)amino]acetic acid?
The canonical SMILES for 2-[cyclopentyl(cyclopentylmethyl)amino]acetic acid is O=C(O)CN(CC1CCCC1)C1CCCC1.
What is the InChIKey of 2-[cyclopentyl(cyclopentylmethyl)amino]acetic acid?
The InChIKey is IZCBHOWQWYIKQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO2/c15-13(16)10-14(12-7-3-4-8-12)9-11-5-1-2-6-11/h11-12H,1-10H2,(H,15,16).
What are the key properties of 2-[cyclopentyl(cyclopentylmethyl)amino]acetic acid?
2-[cyclopentyl(cyclopentylmethyl)amino]acetic acid has a molecular weight of 225.33 g/mol, XLogP of 2.51, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl(cyclopentylmethyl)amino]acetic acid is sourced from PubChem (CID 61342644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).