tert-butyl N-[(2S)-2-(dimethylamino)cyclopentyl]carbamate

C12H24N2O2 — CID 143692343

IUPACtert-butyl N-[(2S)-2-(dimethylamino)cyclopentyl]carbamate
SMILESCN(C)[C@H]1CCCC1NC(=O)OC(C)(C)C
InChIInChI=1S/C12H24N2O2/c1-12(2,3)16-11(15)13-9-7-6-8-10(9)14(4)5/h9-10H,6-8H2,1-5H3,(H,13,15)/t9?,10-/m0/s1
InChIKeyGBYOXNVJBVMRCL-AXDSSHIGSA-N
MW228.34 g/mol
LogP1.99
Rot. Bonds2

About tert-butyl N-[(2S)-2-(dimethylamino)cyclopentyl]carbamate

tert-butyl N-[(2S)-2-(dimethylamino)cyclopentyl]carbamate (PubChem CID 143692343) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is tert-butyl N-[(2S)-2-(dimethylamino)cyclopentyl]carbamate.

Molecular Properties

Compound Nametert-butyl N-[(2S)-2-(dimethylamino)cyclopentyl]carbamate
PubChem CID143692343
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Nametert-butyl N-[(2S)-2-(dimethylamino)cyclopentyl]carbamate
SMILESCN(C)[C@H]1CCCC1NC(=O)OC(C)(C)C
InChIInChI=1S/C12H24N2O2/c1-12(2,3)16-11(15)13-9-7-6-8-10(9)14(4)5/h9-10H,6-8H2,1-5H3,(H,13,15)/t9?,10-/m0/s1
InChIKeyGBYOXNVJBVMRCL-AXDSSHIGSA-N
XLogP1.99
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze tert-butyl N-[(2S)-2-(dimethylamino)cyclopentyl]carbamate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

tert-butyl N-[(1R,2S)-2-methylcyclopentyl]carbamate
CID 162343214
tert-butyl N-[(1S)-2-hydroxycyclopentyl]carbamate
CID 58845331
tert-butyl N-[(1S,2R)-2-hydroxycyclopentyl]carbamate
CID 51416200
tert-butyl N-(2-ethylcyclopentyl)carbamate
CID 131075497
tert-butyl N-[(1S,2S)-2-aminocyclopentyl]carbamate
CID 17040218
[(1R,2S)-2-(dimethylamino)cyclopentyl]carbamic acid
CID 170429908
tert-butyl N-[(1S,2S)-2-formylcyclopentyl]carbamate
CID 96612570
2-[(1S,2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]cyclopentyl]acetic acid
CID 34176591
tert-butyl N-[(1S,2R)-2-[(2-chloroacetyl)-ethylamino]cyclohexyl]carbamate
CID 96552507
tert-butyl N-[(1S,2S)-2-hydroxycyclohexyl]carbamate
CID 10013520
tert-butyl N-[(2S)-2-(methylamino)cyclohexyl]carbamate
CID 163904666
tert-butyl N-[(1R,2S)-2-aminooxycyclopentyl]carbamate
CID 129395964

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[(2S)-2-(dimethylamino)cyclopentyl]carbamate?
The IUPAC name of tert-butyl N-[(2S)-2-(dimethylamino)cyclopentyl]carbamate (CID 143692343) is tert-butyl N-[(2S)-2-(dimethylamino)cyclopentyl]carbamate.
What is the SMILES notation for tert-butyl N-[(2S)-2-(dimethylamino)cyclopentyl]carbamate?
The canonical SMILES for tert-butyl N-[(2S)-2-(dimethylamino)cyclopentyl]carbamate is CN(C)[C@H]1CCCC1NC(=O)OC(C)(C)C.
What is the InChIKey of tert-butyl N-[(2S)-2-(dimethylamino)cyclopentyl]carbamate?
The InChIKey is GBYOXNVJBVMRCL-AXDSSHIGSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-12(2,3)16-11(15)13-9-7-6-8-10(9)14(4)5/h9-10H,6-8H2,1-5H3,(H,13,15)/t9?,10-/m0/s1.
What are the key properties of tert-butyl N-[(2S)-2-(dimethylamino)cyclopentyl]carbamate?
tert-butyl N-[(2S)-2-(dimethylamino)cyclopentyl]carbamate has a molecular weight of 228.34 g/mol, XLogP of 1.99, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[(2S)-2-(dimethylamino)cyclopentyl]carbamate is sourced from PubChem (CID 143692343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).