benzyl N-[(1R,2R)-2-aminocyclopentyl]carbamate

C13H18N2O2 — CID 44625936

IUPACbenzyl N-[(1R,2R)-2-aminocyclopentyl]carbamate
SMILESN[C@@H]1CCC[C@H]1NC(=O)OCc1ccccc1
InChIInChI=1S/C13H18N2O2/c14-11-7-4-8-12(11)15-13(16)17-9-10-5-2-1-3-6-10/h1-3,5-6,11-12H,4,7-9,14H2,(H,15,16)/t11-,12-/m1/s1
InChIKeyJUFLCFJTQMDCIG-VXGBXAGGSA-N
MW234.30 g/mol
LogP1.79
Rot. Bonds3

About benzyl N-[(1R,2R)-2-aminocyclopentyl]carbamate

benzyl N-[(1R,2R)-2-aminocyclopentyl]carbamate (PubChem CID 44625936) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is benzyl N-[(1R,2R)-2-aminocyclopentyl]carbamate.

Molecular Properties

Compound Namebenzyl N-[(1R,2R)-2-aminocyclopentyl]carbamate
PubChem CID44625936
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC Namebenzyl N-[(1R,2R)-2-aminocyclopentyl]carbamate
SMILESN[C@@H]1CCC[C@H]1NC(=O)OCc1ccccc1
InChIInChI=1S/C13H18N2O2/c14-11-7-4-8-12(11)15-13(16)17-9-10-5-2-1-3-6-10/h1-3,5-6,11-12H,4,7-9,14H2,(H,15,16)/t11-,12-/m1/s1
InChIKeyJUFLCFJTQMDCIG-VXGBXAGGSA-N
XLogP1.79
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

benzyl N-[(1S,2R)-2-aminocyclohexyl]carbamate;oxalic acid
CID 91810202
benzyl N-[(1R,2R)-2-aminocyclobutyl]carbamate
CID 135393121
benzyl N-[(1S)-2-(methoxymethyl)cyclohexyl]carbamate
CID 174499936
benzyl N-[(1S,2S,3S)-2,3-dihydroxycyclohexyl]carbamate
CID 57331884
cis-(1R,2S)-2-(phenylmethoxycarbonylamino)cyclopentane-1-carboxylate
CID 11921385
benzyl N-(2-carbamoylcyclohexyl)carbamate
CID 72740883
benzyl N-[(1R,2R)-2-(phenylmethoxycarbonylamino)cyclopropyl]carbamate
CID 11859602
benzyl N-[2-(dimethylamino)cyclopentyl]carbamate
CID 23349723
benzyl N-[(3S,4R)-3-aminopiperidin-4-yl]carbamate
CID 118048951
benzyl N-[(1S,2S)-2-cyanocyclopentyl]carbamate
CID 23636183
phenyl N-(2-aminocycloheptyl)carbamate
CID 63259010
benzyl N-cyclobutylcarbamate;carbonic acid
CID 66730699

Frequently Asked Questions

What is the IUPAC name of benzyl N-[(1R,2R)-2-aminocyclopentyl]carbamate?
The IUPAC name of benzyl N-[(1R,2R)-2-aminocyclopentyl]carbamate (CID 44625936) is benzyl N-[(1R,2R)-2-aminocyclopentyl]carbamate.
What is the SMILES notation for benzyl N-[(1R,2R)-2-aminocyclopentyl]carbamate?
The canonical SMILES for benzyl N-[(1R,2R)-2-aminocyclopentyl]carbamate is N[C@@H]1CCC[C@H]1NC(=O)OCc1ccccc1.
What is the InChIKey of benzyl N-[(1R,2R)-2-aminocyclopentyl]carbamate?
The InChIKey is JUFLCFJTQMDCIG-VXGBXAGGSA-N. The full InChI is InChI=1S/C13H18N2O2/c14-11-7-4-8-12(11)15-13(16)17-9-10-5-2-1-3-6-10/h1-3,5-6,11-12H,4,7-9,14H2,(H,15,16)/t11-,12-/m1/s1.
What are the key properties of benzyl N-[(1R,2R)-2-aminocyclopentyl]carbamate?
benzyl N-[(1R,2R)-2-aminocyclopentyl]carbamate has a molecular weight of 234.30 g/mol, XLogP of 1.79, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl N-[(1R,2R)-2-aminocyclopentyl]carbamate is sourced from PubChem (CID 44625936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).