(1-aminocyclopentyl)methyl N-benzylcarbamate

C14H20N2O2 — CID 107654689

IUPAC(1-aminocyclopentyl)methyl N-benzylcarbamate
SMILESNC1(COC(=O)NCc2ccccc2)CCCC1
InChIInChI=1S/C14H20N2O2/c15-14(8-4-5-9-14)11-18-13(17)16-10-12-6-2-1-3-7-12/h1-3,6-7H,4-5,8-11,15H2,(H,16,17)
InChIKeyGCRFHXMRQXZLPO-UHFFFAOYSA-N
MW248.33 g/mol
LogP2.18
Rot. Bonds4

About (1-aminocyclopentyl)methyl N-benzylcarbamate

(1-aminocyclopentyl)methyl N-benzylcarbamate (PubChem CID 107654689) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is (1-aminocyclopentyl)methyl N-benzylcarbamate.

Molecular Properties

Compound Name(1-aminocyclopentyl)methyl N-benzylcarbamate
PubChem CID107654689
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name(1-aminocyclopentyl)methyl N-benzylcarbamate
SMILESNC1(COC(=O)NCc2ccccc2)CCCC1
InChIInChI=1S/C14H20N2O2/c15-14(8-4-5-9-14)11-18-13(17)16-10-12-6-2-1-3-7-12/h1-3,6-7H,4-5,8-11,15H2,(H,16,17)
InChIKeyGCRFHXMRQXZLPO-UHFFFAOYSA-N
XLogP2.18
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(1-aminocycloheptyl)methoxy]-N-benzylacetamide
CID 64549778
benzyl N-[(1-aminocycloheptyl)methyl]carbamate
CID 66523425
2-(1-aminocyclobutyl)-N-[2-(benzylamino)-2-oxoethyl]acetamide
CID 79854273
(6-phenyl-3-azabicyclo[3.1.0]hexan-6-yl)methyl N-benzylcarbamate
CID 164860541
benzene;ethyl N-benzylcarbamate
CID 67715166
1-amino-N-[(4-phenylmethoxyphenyl)methyl]cyclohexane-1-carboxamide;hydrochloride
CID 119283171
[1-(methoxymethyl)cyclopropyl] N-benzylcarbamate
CID 91421121
3-[[[2-(1-aminocyclopentyl)acetyl]amino]methyl]benzoic acid
CID 64678387
(2-aminocyclohexyl) N-benzylcarbamate
CID 107654721
N-benzyl-2-[2-(benzylamino)-2-oxoethoxy]acetamide
CID 2322352
1-benzyl-3-spiro[2.4]heptan-2-ylurea
CID 131137817
N-benzyl-2-[[1-(hydroxymethyl)cyclopentyl]amino]acetamide
CID 55082631

Frequently Asked Questions

What is the IUPAC name of (1-aminocyclopentyl)methyl N-benzylcarbamate?
The IUPAC name of (1-aminocyclopentyl)methyl N-benzylcarbamate (CID 107654689) is (1-aminocyclopentyl)methyl N-benzylcarbamate.
What is the SMILES notation for (1-aminocyclopentyl)methyl N-benzylcarbamate?
The canonical SMILES for (1-aminocyclopentyl)methyl N-benzylcarbamate is NC1(COC(=O)NCc2ccccc2)CCCC1.
What is the InChIKey of (1-aminocyclopentyl)methyl N-benzylcarbamate?
The InChIKey is GCRFHXMRQXZLPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c15-14(8-4-5-9-14)11-18-13(17)16-10-12-6-2-1-3-7-12/h1-3,6-7H,4-5,8-11,15H2,(H,16,17).
What are the key properties of (1-aminocyclopentyl)methyl N-benzylcarbamate?
(1-aminocyclopentyl)methyl N-benzylcarbamate has a molecular weight of 248.33 g/mol, XLogP of 2.18, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-aminocyclopentyl)methyl N-benzylcarbamate is sourced from PubChem (CID 107654689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).