2-[(1-cyclopropylpyrrolidin-3-yl)amino]cyclobutane-1-carboxylic acid

C12H20N2O2 — CID 103244988

IUPAC2-[(1-cyclopropylpyrrolidin-3-yl)amino]cyclobutane-1-carboxylic acid
SMILESO=C(O)C1CCC1NC1CCN(C2CC2)C1
InChIInChI=1S/C12H20N2O2/c15-12(16)10-3-4-11(10)13-8-5-6-14(7-8)9-1-2-9/h8-11,13H,1-7H2,(H,15,16)
InChIKeySSOLVLZXAKHWGB-UHFFFAOYSA-N
MW224.30 g/mol
LogP0.68
Rot. Bonds4

About 2-[(1-cyclopropylpyrrolidin-3-yl)amino]cyclobutane-1-carboxylic acid

2-[(1-cyclopropylpyrrolidin-3-yl)amino]cyclobutane-1-carboxylic acid (PubChem CID 103244988) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is 2-[(1-cyclopropylpyrrolidin-3-yl)amino]cyclobutane-1-carboxylic acid.

Molecular Properties

Compound Name2-[(1-cyclopropylpyrrolidin-3-yl)amino]cyclobutane-1-carboxylic acid
PubChem CID103244988
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC Name2-[(1-cyclopropylpyrrolidin-3-yl)amino]cyclobutane-1-carboxylic acid
SMILESO=C(O)C1CCC1NC1CCN(C2CC2)C1
InChIInChI=1S/C12H20N2O2/c15-12(16)10-3-4-11(10)13-8-5-6-14(7-8)9-1-2-9/h8-11,13H,1-7H2,(H,15,16)
InChIKeySSOLVLZXAKHWGB-UHFFFAOYSA-N
XLogP0.68
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(1-cyclopropylpyrrolidin-3-yl)amino]-2,2,3-trimethylcyclohexane-1-carboxylic acid
CID 102631024
1-cyclopropyl-3-(ethylamino)piperidine-4-carboxylic acid
CID 83848970
1-[(1-cyclopropylpyrrolidin-3-yl)carbamoyl]-4-methylpiperidine-2-carboxylic acid
CID 114425473
1-cyclopropyl-3-methylpiperidine-4-carboxylic acid
CID 83846866
(2R,4R)-1-[(1-cyclopropylpyrrolidin-3-yl)carbamoyl]-4-hydroxypyrrolidine-2-carboxylic acid
CID 79000138
1-cyclobutyl-3-(1-cyclopropylpyrrolidin-3-yl)urea
CID 115629326
1-cyclopropyl-4-(ethylamino)piperidine-3-carboxylic acid
CID 83848972
1-cyclopropyl-N-(2,3-dimethylcyclohexyl)pyrrolidin-3-amine
CID 62982307
cyclopropyl-[4-[(1-cyclopropylpyrrolidin-3-yl)amino]piperidin-1-yl]methanone
CID 62981831
1-[(1-cyclopropylpyrrolidin-3-yl)carbamoyl]cyclopropane-1-carboxylic acid
CID 62097146
1-cyclopropyl-N-(7-oxabicyclo[2.2.1]heptan-2-yl)pyrrolidin-3-amine
CID 80715147
1-[(1-cyclopropylpyrrolidin-3-yl)carbamoyl]-3-methylpiperidine-2-carboxylic acid
CID 107071548

Frequently Asked Questions

What is the IUPAC name of 2-[(1-cyclopropylpyrrolidin-3-yl)amino]cyclobutane-1-carboxylic acid?
The IUPAC name of 2-[(1-cyclopropylpyrrolidin-3-yl)amino]cyclobutane-1-carboxylic acid (CID 103244988) is 2-[(1-cyclopropylpyrrolidin-3-yl)amino]cyclobutane-1-carboxylic acid.
What is the SMILES notation for 2-[(1-cyclopropylpyrrolidin-3-yl)amino]cyclobutane-1-carboxylic acid?
The canonical SMILES for 2-[(1-cyclopropylpyrrolidin-3-yl)amino]cyclobutane-1-carboxylic acid is O=C(O)C1CCC1NC1CCN(C2CC2)C1.
What is the InChIKey of 2-[(1-cyclopropylpyrrolidin-3-yl)amino]cyclobutane-1-carboxylic acid?
The InChIKey is SSOLVLZXAKHWGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2/c15-12(16)10-3-4-11(10)13-8-5-6-14(7-8)9-1-2-9/h8-11,13H,1-7H2,(H,15,16).
What are the key properties of 2-[(1-cyclopropylpyrrolidin-3-yl)amino]cyclobutane-1-carboxylic acid?
2-[(1-cyclopropylpyrrolidin-3-yl)amino]cyclobutane-1-carboxylic acid has a molecular weight of 224.30 g/mol, XLogP of 0.68, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-cyclopropylpyrrolidin-3-yl)amino]cyclobutane-1-carboxylic acid is sourced from PubChem (CID 103244988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).