1-[(1-cyclopropylpyrrolidin-3-yl)amino]cyclopentane-1-carboxylic acid

C13H22N2O2 — CID 115001282

IUPAC1-[(1-cyclopropylpyrrolidin-3-yl)amino]cyclopentane-1-carboxylic acid
SMILESO=C(O)C1(NC2CCN(C3CC3)C2)CCCC1
InChIInChI=1S/C13H22N2O2/c16-12(17)13(6-1-2-7-13)14-10-5-8-15(9-10)11-3-4-11/h10-11,14H,1-9H2,(H,16,17)
InChIKeyBUVFMWUOHNAXCA-UHFFFAOYSA-N
MW238.33 g/mol
LogP1.21
Rot. Bonds4

About 1-[(1-cyclopropylpyrrolidin-3-yl)amino]cyclopentane-1-carboxylic acid

1-[(1-cyclopropylpyrrolidin-3-yl)amino]cyclopentane-1-carboxylic acid (PubChem CID 115001282) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is 1-[(1-cyclopropylpyrrolidin-3-yl)amino]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name1-[(1-cyclopropylpyrrolidin-3-yl)amino]cyclopentane-1-carboxylic acid
PubChem CID115001282
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC Name1-[(1-cyclopropylpyrrolidin-3-yl)amino]cyclopentane-1-carboxylic acid
SMILESO=C(O)C1(NC2CCN(C3CC3)C2)CCCC1
InChIInChI=1S/C13H22N2O2/c16-12(17)13(6-1-2-7-13)14-10-5-8-15(9-10)11-3-4-11/h10-11,14H,1-9H2,(H,16,17)
InChIKeyBUVFMWUOHNAXCA-UHFFFAOYSA-N
XLogP1.21
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(cyclopropylamino)cyclododecane-1-carboxylic acid
CID 43754451
1-[(1-cyclopropylpyrrolidin-3-yl)carbamoyl]cyclopropane-1-carboxylic acid
CID 62097146
1-amino-N-(1-cyclopropylpyrrolidin-3-yl)cyclohexane-1-carboxamide;dihydrochloride
CID 119864838
N-(1-cyclopropylpyrrolidin-3-yl)-2-[1-(methylamino)cyclohexyl]acetamide
CID 65242656
1-cyclobutyl-3-(1-cyclopropylpyrrolidin-3-yl)urea
CID 115629326
[1-[[(1-cyclopropylpyrrolidin-3-yl)amino]methyl]cyclohexyl]methanol
CID 81419732
4-(cyclopropylamino)-1-methylazepane-4-carboxylic acid
CID 65075425
2-[1-(aminomethyl)cyclohexyl]-N-(1-cyclopropylpyrrolidin-3-yl)acetamide
CID 104678068
1-(cyclopropylamino)-3-(3-methylpiperidin-1-yl)cyclopentane-1-carboxylic acid
CID 79649936
4-(cyclopentylamino)-1-methylazepane-4-carboxylic acid
CID 65075216
1-(cyclopropylamino)-3-piperidin-1-ylcyclopentane-1-carboxylic acid
CID 79649865
1-[(4-methylcyclohexyl)amino]cyclobutane-1-carboxylic acid
CID 81167483

Frequently Asked Questions

What is the IUPAC name of 1-[(1-cyclopropylpyrrolidin-3-yl)amino]cyclopentane-1-carboxylic acid?
The IUPAC name of 1-[(1-cyclopropylpyrrolidin-3-yl)amino]cyclopentane-1-carboxylic acid (CID 115001282) is 1-[(1-cyclopropylpyrrolidin-3-yl)amino]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 1-[(1-cyclopropylpyrrolidin-3-yl)amino]cyclopentane-1-carboxylic acid?
The canonical SMILES for 1-[(1-cyclopropylpyrrolidin-3-yl)amino]cyclopentane-1-carboxylic acid is O=C(O)C1(NC2CCN(C3CC3)C2)CCCC1.
What is the InChIKey of 1-[(1-cyclopropylpyrrolidin-3-yl)amino]cyclopentane-1-carboxylic acid?
The InChIKey is BUVFMWUOHNAXCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2/c16-12(17)13(6-1-2-7-13)14-10-5-8-15(9-10)11-3-4-11/h10-11,14H,1-9H2,(H,16,17).
What are the key properties of 1-[(1-cyclopropylpyrrolidin-3-yl)amino]cyclopentane-1-carboxylic acid?
1-[(1-cyclopropylpyrrolidin-3-yl)amino]cyclopentane-1-carboxylic acid has a molecular weight of 238.33 g/mol, XLogP of 1.21, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1-cyclopropylpyrrolidin-3-yl)amino]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 115001282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).