N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)propyl]pentan-2-amine

C14H28N2O — CID 66370243

IUPACN-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)propyl]pentan-2-amine
SMILESCCCC(C)NCC(C)N1CC2CCC(C1)O2
InChIInChI=1S/C14H28N2O/c1-4-5-11(2)15-8-12(3)16-9-13-6-7-14(10-16)17-13/h11-15H,4-10H2,1-3H3
InChIKeyBHSMWYWGUGNHLU-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.02
Rot. Bonds6

About N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)propyl]pentan-2-amine

N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)propyl]pentan-2-amine (PubChem CID 66370243) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)propyl]pentan-2-amine.

Molecular Properties

Compound NameN-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)propyl]pentan-2-amine
PubChem CID66370243
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)propyl]pentan-2-amine
SMILESCCCC(C)NCC(C)N1CC2CCC(C1)O2
InChIInChI=1S/C14H28N2O/c1-4-5-11(2)15-8-12(3)16-9-13-6-7-14(10-16)17-13/h11-15H,4-10H2,1-3H3
InChIKeyBHSMWYWGUGNHLU-UHFFFAOYSA-N
XLogP2.02
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)propyl]pentan-2-amine with MolForge

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Related Compounds

4-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-propylpentan-2-amine
CID 66391124
N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)propyl]pentan-1-amine
CID 66369464
3-methyl-N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)propyl]butan-1-amine
CID 66370840
2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-prop-2-enylpropan-1-amine
CID 66371810
N-[2-(4-ethyl-3-methylpiperazin-1-yl)propyl]pentan-2-amine
CID 63621701
N-ethyl-5-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pentan-2-amine
CID 66391705
methyl 3-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)butanoate
CID 66391355
N-(2-cyclohexylsulfanylpropyl)pentan-2-amine
CID 62579529
N-(2-morpholin-4-ylpropyl)hexan-2-amine
CID 115708396
N-propan-2-yl-2-(4-propylpiperidin-1-yl)propan-1-amine
CID 62439844
2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pentan-3-one
CID 66393672
N-methyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pentan-2-amine
CID 66391107

Frequently Asked Questions

What is the IUPAC name of N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)propyl]pentan-2-amine?
The IUPAC name of N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)propyl]pentan-2-amine (CID 66370243) is N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)propyl]pentan-2-amine.
What is the SMILES notation for N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)propyl]pentan-2-amine?
The canonical SMILES for N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)propyl]pentan-2-amine is CCCC(C)NCC(C)N1CC2CCC(C1)O2.
What is the InChIKey of N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)propyl]pentan-2-amine?
The InChIKey is BHSMWYWGUGNHLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-4-5-11(2)15-8-12(3)16-9-13-6-7-14(10-16)17-13/h11-15H,4-10H2,1-3H3.
What are the key properties of N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)propyl]pentan-2-amine?
N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)propyl]pentan-2-amine has a molecular weight of 240.39 g/mol, XLogP of 2.02, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)propyl]pentan-2-amine is sourced from PubChem (CID 66370243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).