N-cycloheptyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine

C17H32N2 — CID 61232838

IUPACN-cycloheptyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
SMILESCCCN(C1CCCCCC1)C1CC2CCC(C1)N2
InChIInChI=1S/C17H32N2/c1-2-11-19(16-7-5-3-4-6-8-16)17-12-14-9-10-15(13-17)18-14/h14-18H,2-13H2,1H3
InChIKeyUISGZJZEHSWYGJ-UHFFFAOYSA-N
MW264.46 g/mol
LogP3.70
Rot. Bonds4

About N-cycloheptyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine

N-cycloheptyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine (PubChem CID 61232838) has the molecular formula C17H32N2 and a molecular weight of 264.46 g/mol. Its IUPAC name is N-cycloheptyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine.

Molecular Properties

Compound NameN-cycloheptyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
PubChem CID61232838
Molecular FormulaC17H32N2
Molecular Weight264.46 g/mol
Exact Mass264.26
IUPAC NameN-cycloheptyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
SMILESCCCN(C1CCCCCC1)C1CC2CCC(C1)N2
InChIInChI=1S/C17H32N2/c1-2-11-19(16-7-5-3-4-6-8-16)17-12-14-9-10-15(13-17)18-14/h14-18H,2-13H2,1H3
InChIKeyUISGZJZEHSWYGJ-UHFFFAOYSA-N
XLogP3.70
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.46
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(oxan-4-yl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
CID 61232456
N-propyl-N-(thian-3-yl)-8-azabicyclo[3.2.1]octan-3-amine
CID 62873306
N-(3,5-dimethylcyclohexyl)-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
CID 64752902
N-cyclohexyl-N-propylazetidin-3-amine
CID 66183284
(1R,5S)-N-methyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
CID 26189078
N-ethyl-N-(4-propylcycloheptyl)-8-azabicyclo[3.2.1]octan-3-amine
CID 65088688
4-N-cycloheptyl-4-N-propylcyclohexane-1,4-diamine
CID 79111561
N-cyclohexyl-N-methyl-8-azabicyclo[3.2.1]octan-3-amine
CID 45075231
N-propan-2-yl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
CID 61232461
N-(8-azabicyclo[3.2.1]octan-3-yl)-N-propylcyclopentanesulfonamide
CID 105361380
2-[8-azabicyclo[3.2.1]octan-3-yl(ethyl)amino]cyclopentan-1-ol
CID 61231361
N-pentyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
CID 61230427

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine?
The IUPAC name of N-cycloheptyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine (CID 61232838) is N-cycloheptyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine.
What is the SMILES notation for N-cycloheptyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine?
The canonical SMILES for N-cycloheptyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine is CCCN(C1CCCCCC1)C1CC2CCC(C1)N2.
What is the InChIKey of N-cycloheptyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine?
The InChIKey is UISGZJZEHSWYGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2/c1-2-11-19(16-7-5-3-4-6-8-16)17-12-14-9-10-15(13-17)18-14/h14-18H,2-13H2,1H3.
What are the key properties of N-cycloheptyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine?
N-cycloheptyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine has a molecular weight of 264.46 g/mol, XLogP of 3.70, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine is sourced from PubChem (CID 61232838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).