(2S,4R)-N-cyclobutyl-4-hydroxypyrrolidine-2-carboxamide

C9H16N2O2 — CID 66855041

IUPAC(2S,4R)-N-cyclobutyl-4-hydroxypyrrolidine-2-carboxamide
SMILESO=C(NC1CCC1)[C@@H]1C[C@@H](O)CN1
InChIInChI=1S/C9H16N2O2/c12-7-4-8(10-5-7)9(13)11-6-2-1-3-6/h6-8,10,12H,1-5H2,(H,11,13)/t7-,8+/m1/s1
InChIKeyBZASELJQKCEBPG-SFYZADRCSA-N
MW184.24 g/mol
LogP-0.62
Rot. Bonds2

About (2S,4R)-N-cyclobutyl-4-hydroxypyrrolidine-2-carboxamide

(2S,4R)-N-cyclobutyl-4-hydroxypyrrolidine-2-carboxamide (PubChem CID 66855041) has the molecular formula C9H16N2O2 and a molecular weight of 184.24 g/mol. Its IUPAC name is (2S,4R)-N-cyclobutyl-4-hydroxypyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2S,4R)-N-cyclobutyl-4-hydroxypyrrolidine-2-carboxamide
PubChem CID66855041
Molecular FormulaC9H16N2O2
Molecular Weight184.24 g/mol
Exact Mass184.12
IUPAC Name(2S,4R)-N-cyclobutyl-4-hydroxypyrrolidine-2-carboxamide
SMILESO=C(NC1CCC1)[C@@H]1C[C@@H](O)CN1
InChIInChI=1S/C9H16N2O2/c12-7-4-8(10-5-7)9(13)11-6-2-1-3-6/h6-8,10,12H,1-5H2,(H,11,13)/t7-,8+/m1/s1
InChIKeyBZASELJQKCEBPG-SFYZADRCSA-N
XLogP-0.62
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 5-0.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-hydroxy-N-(3-methylcyclohexyl)pyrrolidine-2-carboxamide
CID 43317965
4-hydroxy-N-(thian-3-yl)pyrrolidine-2-carboxamide
CID 115740732
N-(3-ethylcyclohexyl)-4-hydroxypyrrolidine-2-carboxamide
CID 64748039
4-hydroxy-N-[4-(hydroxymethyl)cyclohexyl]pyrrolidine-2-carboxamide
CID 112753360
N-(1,1-dioxothian-3-yl)-4-hydroxypyrrolidine-2-carboxamide
CID 63922551
4-hydroxy-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide
CID 61212180
N-cyclohexylaziridine-2-carboxamide
CID 142164432
(2R,4S)-N-[(3S)-1-ethylpiperidin-3-yl]-4-hydroxypyrrolidine-2-carboxamide
CID 124832336
4-hydroxy-N-(1-propylpiperidin-4-yl)pyrrolidine-2-carboxamide;dihydrochloride
CID 119834916
N-cyclohexylaziridine-2-carboxamide;methanol
CID 142164431
N-(2,3-dimethylcyclohexyl)-4-hydroxypyrrolidine-2-carboxamide;hydrochloride
CID 120607881
(2S,4R)-4-hydroxypyrrolidine-2-carbohydrazide
CID 45084250

Frequently Asked Questions

What is the IUPAC name of (2S,4R)-N-cyclobutyl-4-hydroxypyrrolidine-2-carboxamide?
The IUPAC name of (2S,4R)-N-cyclobutyl-4-hydroxypyrrolidine-2-carboxamide (CID 66855041) is (2S,4R)-N-cyclobutyl-4-hydroxypyrrolidine-2-carboxamide.
What is the SMILES notation for (2S,4R)-N-cyclobutyl-4-hydroxypyrrolidine-2-carboxamide?
The canonical SMILES for (2S,4R)-N-cyclobutyl-4-hydroxypyrrolidine-2-carboxamide is O=C(NC1CCC1)[C@@H]1C[C@@H](O)CN1.
What is the InChIKey of (2S,4R)-N-cyclobutyl-4-hydroxypyrrolidine-2-carboxamide?
The InChIKey is BZASELJQKCEBPG-SFYZADRCSA-N. The full InChI is InChI=1S/C9H16N2O2/c12-7-4-8(10-5-7)9(13)11-6-2-1-3-6/h6-8,10,12H,1-5H2,(H,11,13)/t7-,8+/m1/s1.
What are the key properties of (2S,4R)-N-cyclobutyl-4-hydroxypyrrolidine-2-carboxamide?
(2S,4R)-N-cyclobutyl-4-hydroxypyrrolidine-2-carboxamide has a molecular weight of 184.24 g/mol, XLogP of -0.62, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,4R)-N-cyclobutyl-4-hydroxypyrrolidine-2-carboxamide is sourced from PubChem (CID 66855041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).