tert-butyl N-(2-aminospiro[3.5]nonan-8-yl)carbamate;hydrochloride

C14H27ClN2O2 — CID 155894270

IUPACtert-butyl N-(2-aminospiro[3.5]nonan-8-yl)carbamate;hydrochloride
SMILESCC(C)(C)OC(=O)NC1CCCC2(CC(N)C2)C1.Cl
InChIInChI=1S/C14H26N2O2.ClH/c1-13(2,3)18-12(17)16-11-5-4-6-14(9-11)7-10(15)8-14;/h10-11H,4-9,15H2,1-3H3,(H,16,17);1H
InChIKeySEVGWVLMSRYKQV-UHFFFAOYSA-N
MW290.84 g/mol
LogP2.98
Rot. Bonds1

About tert-butyl N-(2-aminospiro[3.5]nonan-8-yl)carbamate;hydrochloride

tert-butyl N-(2-aminospiro[3.5]nonan-8-yl)carbamate;hydrochloride (PubChem CID 155894270) has the molecular formula C14H27ClN2O2 and a molecular weight of 290.84 g/mol. Its IUPAC name is tert-butyl N-(2-aminospiro[3.5]nonan-8-yl)carbamate;hydrochloride.

Molecular Properties

Compound Nametert-butyl N-(2-aminospiro[3.5]nonan-8-yl)carbamate;hydrochloride
PubChem CID155894270
Molecular FormulaC14H27ClN2O2
Molecular Weight290.84 g/mol
Exact Mass290.18
IUPAC Nametert-butyl N-(2-aminospiro[3.5]nonan-8-yl)carbamate;hydrochloride
SMILESCC(C)(C)OC(=O)NC1CCCC2(CC(N)C2)C1.Cl
InChIInChI=1S/C14H26N2O2.ClH/c1-13(2,3)18-12(17)16-11-5-4-6-14(9-11)7-10(15)8-14;/h10-11H,4-9,15H2,1-3H3,(H,16,17);1H
InChIKeySEVGWVLMSRYKQV-UHFFFAOYSA-N
XLogP2.98
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.84
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 97299724
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tert-butyl N-(2-ethyl-2-azaspiro[3.3]heptan-6-yl)carbamate;2-ethyl-2-azaspiro[3.3]heptan-6-amine;hydrochloride
CID 160978622
tert-butyl N-(4-aminocyclohexyl)carbamate;dihydrochloride
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CID 147656644
tert-butyl N-(2-azaspiro[3.3]heptan-6-yl)carbamate;hydrochloride
CID 86767491
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Frequently Asked Questions

What is the IUPAC name of tert-butyl N-(2-aminospiro[3.5]nonan-8-yl)carbamate;hydrochloride?
The IUPAC name of tert-butyl N-(2-aminospiro[3.5]nonan-8-yl)carbamate;hydrochloride (CID 155894270) is tert-butyl N-(2-aminospiro[3.5]nonan-8-yl)carbamate;hydrochloride.
What is the SMILES notation for tert-butyl N-(2-aminospiro[3.5]nonan-8-yl)carbamate;hydrochloride?
The canonical SMILES for tert-butyl N-(2-aminospiro[3.5]nonan-8-yl)carbamate;hydrochloride is CC(C)(C)OC(=O)NC1CCCC2(CC(N)C2)C1.Cl.
What is the InChIKey of tert-butyl N-(2-aminospiro[3.5]nonan-8-yl)carbamate;hydrochloride?
The InChIKey is SEVGWVLMSRYKQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2.ClH/c1-13(2,3)18-12(17)16-11-5-4-6-14(9-11)7-10(15)8-14;/h10-11H,4-9,15H2,1-3H3,(H,16,17);1H.
What are the key properties of tert-butyl N-(2-aminospiro[3.5]nonan-8-yl)carbamate;hydrochloride?
tert-butyl N-(2-aminospiro[3.5]nonan-8-yl)carbamate;hydrochloride has a molecular weight of 290.84 g/mol, XLogP of 2.98, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-(2-aminospiro[3.5]nonan-8-yl)carbamate;hydrochloride is sourced from PubChem (CID 155894270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).