1-(cyclopropylamino)-2-[2-(oxolan-3-yloxy)ethyl]cyclopentane-1-carboxylic acid

C15H25NO4 — CID 79587752

IUPAC1-(cyclopropylamino)-2-[2-(oxolan-3-yloxy)ethyl]cyclopentane-1-carboxylic acid
SMILESO=C(O)C1(NC2CC2)CCCC1CCOC1CCOC1
InChIInChI=1S/C15H25NO4/c17-14(18)15(16-12-3-4-12)7-1-2-11(15)5-9-20-13-6-8-19-10-13/h11-13,16H,1-10H2,(H,17,18)
InChIKeyGEIUYDZNWOQZOX-UHFFFAOYSA-N
MW283.37 g/mol
LogP1.56
Rot. Bonds7

About 1-(cyclopropylamino)-2-[2-(oxolan-3-yloxy)ethyl]cyclopentane-1-carboxylic acid

1-(cyclopropylamino)-2-[2-(oxolan-3-yloxy)ethyl]cyclopentane-1-carboxylic acid (PubChem CID 79587752) has the molecular formula C15H25NO4 and a molecular weight of 283.37 g/mol. Its IUPAC name is 1-(cyclopropylamino)-2-[2-(oxolan-3-yloxy)ethyl]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name1-(cyclopropylamino)-2-[2-(oxolan-3-yloxy)ethyl]cyclopentane-1-carboxylic acid
PubChem CID79587752
Molecular FormulaC15H25NO4
Molecular Weight283.37 g/mol
Exact Mass283.18
IUPAC Name1-(cyclopropylamino)-2-[2-(oxolan-3-yloxy)ethyl]cyclopentane-1-carboxylic acid
SMILESO=C(O)C1(NC2CC2)CCCC1CCOC1CCOC1
InChIInChI=1S/C15H25NO4/c17-14(18)15(16-12-3-4-12)7-1-2-11(15)5-9-20-13-6-8-19-10-13/h11-13,16H,1-10H2,(H,17,18)
InChIKeyGEIUYDZNWOQZOX-UHFFFAOYSA-N
XLogP1.56
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(cyclopropylamino)-2-(2-methoxyethyl)cyclopentane-1-carboxylic acid
CID 79581172
2-(2-cyclobutyloxyethyl)-1-(cyclopropylamino)cyclopentane-1-carboxamide
CID 79587218
[1-(methylamino)-2-[2-(oxolan-3-yloxy)ethyl]cyclopentyl]methanol
CID 79580990
ethyl 1-(methylamino)-2-[2-(oxan-4-yloxy)ethyl]cyclopentane-1-carboxylate
CID 79567356
1-(cyclopropylamino)-2-[2-(dipropylamino)ethyl]cyclopentane-1-carboxylic acid
CID 79577441
1-(cyclopropylamino)-2-(2-propan-2-ylsulfanylethyl)cyclopentane-1-carboxylic acid
CID 79587823
1-(cyclopropylamino)-2-[2-[ethyl(propan-2-yl)amino]ethyl]cyclopentane-1-carboxylic acid
CID 79563971
methyl 1-amino-2-[2-(oxan-4-yloxy)ethyl]cyclopentane-1-carboxylate
CID 79571458
2-(2-methoxyethyl)-1-(methylamino)cyclopentane-1-carboxylic acid
CID 79581865
2-[2-(oxolan-3-yloxy)ethyl]-1-(propylamino)cyclopentane-1-carbonitrile
CID 79578008
methyl 2-(2-cyclohexyloxyethyl)-1-(methylamino)cyclopentane-1-carboxylate
CID 79581318
methyl 1-(methylamino)-2-[2-(oxolan-3-ylmethoxy)ethyl]cyclopentane-1-carboxylate
CID 79571672

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylamino)-2-[2-(oxolan-3-yloxy)ethyl]cyclopentane-1-carboxylic acid?
The IUPAC name of 1-(cyclopropylamino)-2-[2-(oxolan-3-yloxy)ethyl]cyclopentane-1-carboxylic acid (CID 79587752) is 1-(cyclopropylamino)-2-[2-(oxolan-3-yloxy)ethyl]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 1-(cyclopropylamino)-2-[2-(oxolan-3-yloxy)ethyl]cyclopentane-1-carboxylic acid?
The canonical SMILES for 1-(cyclopropylamino)-2-[2-(oxolan-3-yloxy)ethyl]cyclopentane-1-carboxylic acid is O=C(O)C1(NC2CC2)CCCC1CCOC1CCOC1.
What is the InChIKey of 1-(cyclopropylamino)-2-[2-(oxolan-3-yloxy)ethyl]cyclopentane-1-carboxylic acid?
The InChIKey is GEIUYDZNWOQZOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO4/c17-14(18)15(16-12-3-4-12)7-1-2-11(15)5-9-20-13-6-8-19-10-13/h11-13,16H,1-10H2,(H,17,18).
What are the key properties of 1-(cyclopropylamino)-2-[2-(oxolan-3-yloxy)ethyl]cyclopentane-1-carboxylic acid?
1-(cyclopropylamino)-2-[2-(oxolan-3-yloxy)ethyl]cyclopentane-1-carboxylic acid has a molecular weight of 283.37 g/mol, XLogP of 1.56, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylamino)-2-[2-(oxolan-3-yloxy)ethyl]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 79587752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).