N-(cyclopropylmethyl)-N-ethyl-8-azabicyclo[3.2.1]octan-3-amine

C13H24N2 — CID 61233017

IUPACN-(cyclopropylmethyl)-N-ethyl-8-azabicyclo[3.2.1]octan-3-amine
SMILESCCN(CC1CC1)C1CC2CCC(C1)N2
InChIInChI=1S/C13H24N2/c1-2-15(9-10-3-4-10)13-7-11-5-6-12(8-13)14-11/h10-14H,2-9H2,1H3
InChIKeyJBDMXBPBCICWQB-UHFFFAOYSA-N
MW208.35 g/mol
LogP2.00
Rot. Bonds4

About N-(cyclopropylmethyl)-N-ethyl-8-azabicyclo[3.2.1]octan-3-amine

N-(cyclopropylmethyl)-N-ethyl-8-azabicyclo[3.2.1]octan-3-amine (PubChem CID 61233017) has the molecular formula C13H24N2 and a molecular weight of 208.35 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-N-ethyl-8-azabicyclo[3.2.1]octan-3-amine.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-N-ethyl-8-azabicyclo[3.2.1]octan-3-amine
PubChem CID61233017
Molecular FormulaC13H24N2
Molecular Weight208.35 g/mol
Exact Mass208.19
IUPAC NameN-(cyclopropylmethyl)-N-ethyl-8-azabicyclo[3.2.1]octan-3-amine
SMILESCCN(CC1CC1)C1CC2CCC(C1)N2
InChIInChI=1S/C13H24N2/c1-2-15(9-10-3-4-10)13-7-11-5-6-12(8-13)14-11/h10-14H,2-9H2,1H3
InChIKeyJBDMXBPBCICWQB-UHFFFAOYSA-N
XLogP2.00
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.35
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(cyclopropylmethyl)-N-methyl-8-azabicyclo[3.2.1]octan-3-amine
CID 61230844
N-(2-cyclopentylethyl)-N-ethyl-8-azabicyclo[3.2.1]octan-3-amine
CID 114191604
N-ethyl-N-(2-ethylbutyl)-8-azabicyclo[3.2.1]octan-3-amine
CID 61231107
N-(2,3-dichloroprop-2-enyl)-N-ethyl-8-azabicyclo[3.2.1]octan-3-amine
CID 79173476
1-[8-azabicyclo[3.2.1]octan-3-yl(ethyl)amino]propan-2-ol
CID 61231550
2-[8-azabicyclo[3.2.1]octan-3-yl(ethyl)amino]-N-ethyl-N-methylacetamide
CID 61230973
N-[2-(8-azabicyclo[3.2.1]octan-3-yl)ethyl]-N-ethylcyclopropanamine
CID 79615192
N-ethyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-8-azabicyclo[3.2.1]octan-3-amine
CID 61231921
tert-butyl 2-[8-azabicyclo[3.2.1]octan-3-yl(ethyl)amino]acetate
CID 61230595
N-benzyl-N-ethyl-8-azabicyclo[3.2.1]octan-3-amine
CID 61231293
N-ethyl-N-(4-methoxybutyl)-8-azabicyclo[3.2.1]octan-3-amine
CID 104648573
N-ethyl-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]-8-azabicyclo[3.2.1]octan-3-amine
CID 112590844

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-N-ethyl-8-azabicyclo[3.2.1]octan-3-amine?
The IUPAC name of N-(cyclopropylmethyl)-N-ethyl-8-azabicyclo[3.2.1]octan-3-amine (CID 61233017) is N-(cyclopropylmethyl)-N-ethyl-8-azabicyclo[3.2.1]octan-3-amine.
What is the SMILES notation for N-(cyclopropylmethyl)-N-ethyl-8-azabicyclo[3.2.1]octan-3-amine?
The canonical SMILES for N-(cyclopropylmethyl)-N-ethyl-8-azabicyclo[3.2.1]octan-3-amine is CCN(CC1CC1)C1CC2CCC(C1)N2.
What is the InChIKey of N-(cyclopropylmethyl)-N-ethyl-8-azabicyclo[3.2.1]octan-3-amine?
The InChIKey is JBDMXBPBCICWQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2/c1-2-15(9-10-3-4-10)13-7-11-5-6-12(8-13)14-11/h10-14H,2-9H2,1H3.
What are the key properties of N-(cyclopropylmethyl)-N-ethyl-8-azabicyclo[3.2.1]octan-3-amine?
N-(cyclopropylmethyl)-N-ethyl-8-azabicyclo[3.2.1]octan-3-amine has a molecular weight of 208.35 g/mol, XLogP of 2.00, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-N-ethyl-8-azabicyclo[3.2.1]octan-3-amine is sourced from PubChem (CID 61233017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).