[(1S,3S)-3-(tert-butylamino)cyclopentyl] carbamate

C10H20N2O2 — CID 177250020

IUPAC[(1S,3S)-3-(tert-butylamino)cyclopentyl] carbamate
SMILESCC(C)(C)N[C@H]1CC[C@H](OC(N)=O)C1
InChIInChI=1S/C10H20N2O2/c1-10(2,3)12-7-4-5-8(6-7)14-9(11)13/h7-8,12H,4-6H2,1-3H3,(H2,11,13)/t7-,8-/m0/s1
InChIKeyINXRPBXOVGCRJW-YUMQZZPRSA-N
MW200.28 g/mol
LogP1.39
Rot. Bonds2

About [(1S,3S)-3-(tert-butylamino)cyclopentyl] carbamate

[(1S,3S)-3-(tert-butylamino)cyclopentyl] carbamate (PubChem CID 177250020) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is [(1S,3S)-3-(tert-butylamino)cyclopentyl] carbamate.

Molecular Properties

Compound Name[(1S,3S)-3-(tert-butylamino)cyclopentyl] carbamate
PubChem CID177250020
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name[(1S,3S)-3-(tert-butylamino)cyclopentyl] carbamate
SMILESCC(C)(C)N[C@H]1CC[C@H](OC(N)=O)C1
InChIInChI=1S/C10H20N2O2/c1-10(2,3)12-7-4-5-8(6-7)14-9(11)13/h7-8,12H,4-6H2,1-3H3,(H2,11,13)/t7-,8-/m0/s1
InChIKeyINXRPBXOVGCRJW-YUMQZZPRSA-N
XLogP1.39
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[3-[4-(2-methylbutan-2-yl)anilino]cyclopentyl] carbamate
CID 175562349
[(1R,3R)-3-aminocyclopentyl] carbamate
CID 154024517
[(3S)-3-aminocyclopentyl] carbamate
CID 175196107
[3-(4-tert-butylanilino)cyclobutyl] carbamate
CID 175562231
N-[(1R,3S)-3-(tert-butylamino)cyclopentyl]acetamide
CID 139573847
[(1S,3R)-3-fluorocyclopentyl] carbamate
CID 175108373
[4-[4-(2-methylbutan-2-yl)anilino]cyclohexyl] carbamate
CID 175562141
(4-methylcyclohexyl) carbamate
CID 22083226
1-N,4-N-ditert-butylcyclohexane-1,4-diamine
CID 59732223
[(1S,3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]cyclopentyl] acetate
CID 141204267
N-tert-butylcyclopropanamine;hydrochloride
CID 55284152
(4-propan-2-ylcyclohexyl) carbamate
CID 122545653

Frequently Asked Questions

What is the IUPAC name of [(1S,3S)-3-(tert-butylamino)cyclopentyl] carbamate?
The IUPAC name of [(1S,3S)-3-(tert-butylamino)cyclopentyl] carbamate (CID 177250020) is [(1S,3S)-3-(tert-butylamino)cyclopentyl] carbamate.
What is the SMILES notation for [(1S,3S)-3-(tert-butylamino)cyclopentyl] carbamate?
The canonical SMILES for [(1S,3S)-3-(tert-butylamino)cyclopentyl] carbamate is CC(C)(C)N[C@H]1CC[C@H](OC(N)=O)C1.
What is the InChIKey of [(1S,3S)-3-(tert-butylamino)cyclopentyl] carbamate?
The InChIKey is INXRPBXOVGCRJW-YUMQZZPRSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-10(2,3)12-7-4-5-8(6-7)14-9(11)13/h7-8,12H,4-6H2,1-3H3,(H2,11,13)/t7-,8-/m0/s1.
What are the key properties of [(1S,3S)-3-(tert-butylamino)cyclopentyl] carbamate?
[(1S,3S)-3-(tert-butylamino)cyclopentyl] carbamate has a molecular weight of 200.28 g/mol, XLogP of 1.39, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(1S,3S)-3-(tert-butylamino)cyclopentyl] carbamate is sourced from PubChem (CID 177250020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).