(2-aminocyclopentyl)-[(3S,4R)-3,4-dihydroxypyrrolidin-1-yl]methanone

C10H18N2O3 — CID 107220787

IUPAC(2-aminocyclopentyl)-[(3S,4R)-3,4-dihydroxypyrrolidin-1-yl]methanone
SMILESNC1CCCC1C(=O)N1C[C@@H](O)[C@@H](O)C1
InChIInChI=1S/C10H18N2O3/c11-7-3-1-2-6(7)10(15)12-4-8(13)9(14)5-12/h6-9,13-14H,1-5,11H2/t6?,7?,8-,9+
InChIKeyZZPMWLUGORXJJO-WZENYGAOSA-N
MW214.26 g/mol
LogP-1.32
Rot. Bonds1

About (2-aminocyclopentyl)-[(3S,4R)-3,4-dihydroxypyrrolidin-1-yl]methanone

(2-aminocyclopentyl)-[(3S,4R)-3,4-dihydroxypyrrolidin-1-yl]methanone (PubChem CID 107220787) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is (2-aminocyclopentyl)-[(3S,4R)-3,4-dihydroxypyrrolidin-1-yl]methanone.

Molecular Properties

Compound Name(2-aminocyclopentyl)-[(3S,4R)-3,4-dihydroxypyrrolidin-1-yl]methanone
PubChem CID107220787
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC Name(2-aminocyclopentyl)-[(3S,4R)-3,4-dihydroxypyrrolidin-1-yl]methanone
SMILESNC1CCCC1C(=O)N1C[C@@H](O)[C@@H](O)C1
InChIInChI=1S/C10H18N2O3/c11-7-3-1-2-6(7)10(15)12-4-8(13)9(14)5-12/h6-9,13-14H,1-5,11H2/t6?,7?,8-,9+
InChIKeyZZPMWLUGORXJJO-WZENYGAOSA-N
XLogP-1.32
TPSA86.79 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 5-1.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

(2-aminocyclohexyl)-(4-hydroxypiperidin-1-yl)methanone
CID 62776127
1-[4-(2-aminocyclopentanecarbonyl)piperazin-1-yl]ethanone;hydrochloride
CID 119399085
[(1S,2R)-2-aminocyclopentyl]-thiomorpholin-4-ylmethanone
CID 164661854
(3-amino-2-methylcyclohexyl)-(3,4-dimethylpyrrolidin-1-yl)methanone
CID 79186972
(2-aminocyclopentyl)-[3-(hydroxymethyl)pyrrolidin-1-yl]methanone
CID 112624969
(3-hydroxyazetidin-1-yl)-(2-hydroxycyclopentyl)methanone
CID 127009481
(2-aminocyclopentyl)-(4-benzoylpiperazin-1-yl)methanone
CID 119683412
(2-aminocyclohexyl)-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]methanone
CID 81464588
(2-aminocyclopentyl)-(4-tert-butylpiperazin-1-yl)methanone
CID 64823652
(2-aminocyclopentyl)-(4-ethylpiperidin-1-yl)methanone
CID 64823610
[(3R,4S)-3,4-dihydroxypyrrolidin-1-yl]-[2-(trifluoromethyl)cyclohexyl]methanone
CID 103857587
(2-aminocyclopentyl)-[3-(methoxymethyl)pyrrolidin-1-yl]methanone
CID 64853017

Frequently Asked Questions

What is the IUPAC name of (2-aminocyclopentyl)-[(3S,4R)-3,4-dihydroxypyrrolidin-1-yl]methanone?
The IUPAC name of (2-aminocyclopentyl)-[(3S,4R)-3,4-dihydroxypyrrolidin-1-yl]methanone (CID 107220787) is (2-aminocyclopentyl)-[(3S,4R)-3,4-dihydroxypyrrolidin-1-yl]methanone.
What is the SMILES notation for (2-aminocyclopentyl)-[(3S,4R)-3,4-dihydroxypyrrolidin-1-yl]methanone?
The canonical SMILES for (2-aminocyclopentyl)-[(3S,4R)-3,4-dihydroxypyrrolidin-1-yl]methanone is NC1CCCC1C(=O)N1C[C@@H](O)[C@@H](O)C1.
What is the InChIKey of (2-aminocyclopentyl)-[(3S,4R)-3,4-dihydroxypyrrolidin-1-yl]methanone?
The InChIKey is ZZPMWLUGORXJJO-WZENYGAOSA-N. The full InChI is InChI=1S/C10H18N2O3/c11-7-3-1-2-6(7)10(15)12-4-8(13)9(14)5-12/h6-9,13-14H,1-5,11H2/t6?,7?,8-,9+.
What are the key properties of (2-aminocyclopentyl)-[(3S,4R)-3,4-dihydroxypyrrolidin-1-yl]methanone?
(2-aminocyclopentyl)-[(3S,4R)-3,4-dihydroxypyrrolidin-1-yl]methanone has a molecular weight of 214.26 g/mol, XLogP of -1.32, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-aminocyclopentyl)-[(3S,4R)-3,4-dihydroxypyrrolidin-1-yl]methanone is sourced from PubChem (CID 107220787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).