N-(pyridin-4-ylmethyl)cyclooctanamine

C14H22N2 — CID 4722994

IUPACN-(pyridin-4-ylmethyl)cyclooctanamine
SMILESc1cc(CNC2CCCCCCC2)ccn1
InChIInChI=1S/C14H22N2/c1-2-4-6-14(7-5-3-1)16-12-13-8-10-15-11-9-13/h8-11,14,16H,1-7,12H2
InChIKeySJTRSHUEQIZNGE-UHFFFAOYSA-N
MW218.34 g/mol
LogP3.28
Rot. Bonds3

About N-(pyridin-4-ylmethyl)cyclooctanamine

N-(pyridin-4-ylmethyl)cyclooctanamine (PubChem CID 4722994) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is N-(pyridin-4-ylmethyl)cyclooctanamine.

Molecular Properties

Compound NameN-(pyridin-4-ylmethyl)cyclooctanamine
PubChem CID4722994
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC NameN-(pyridin-4-ylmethyl)cyclooctanamine
SMILESc1cc(CNC2CCCCCCC2)ccn1
InChIInChI=1S/C14H22N2/c1-2-4-6-14(7-5-3-1)16-12-13-8-10-15-11-9-13/h8-11,14,16H,1-7,12H2
InChIKeySJTRSHUEQIZNGE-UHFFFAOYSA-N
XLogP3.28
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-propan-2-yl-N-(pyridin-4-ylmethyl)cycloheptan-1-amine
CID 65087684
N-(pyridazin-4-ylmethyl)cyclohexanamine
CID 104670108
benzene;N-benzylcyclohexanamine
CID 142622843
[4-(pyridin-4-ylmethylamino)cyclohexyl]methanol
CID 103753143
(3R)-N-(pyridin-4-ylmethyl)piperidin-3-amine;trihydrochloride
CID 53256507
N-(pyridin-4-ylmethyl)-1-pyrimidin-2-ylpiperidin-4-amine
CID 43675588
N-[[4-(triazol-2-yl)phenyl]methyl]cycloheptanamine
CID 10730786
N-(pyridin-4-ylmethyl)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-amine
CID 174900275
N-[(4-bromophenyl)methyl]cycloheptanamine;hydrochloride
CID 17294485
N-(pyridin-4-ylmethyl)oxolan-3-amine
CID 63331890
1-tert-butyl-N-(pyridin-4-ylmethyl)piperidin-4-amine
CID 51085983
4-[(cyclopentylamino)methyl]phenol
CID 3873791

Frequently Asked Questions

What is the IUPAC name of N-(pyridin-4-ylmethyl)cyclooctanamine?
The IUPAC name of N-(pyridin-4-ylmethyl)cyclooctanamine (CID 4722994) is N-(pyridin-4-ylmethyl)cyclooctanamine.
What is the SMILES notation for N-(pyridin-4-ylmethyl)cyclooctanamine?
The canonical SMILES for N-(pyridin-4-ylmethyl)cyclooctanamine is c1cc(CNC2CCCCCCC2)ccn1.
What is the InChIKey of N-(pyridin-4-ylmethyl)cyclooctanamine?
The InChIKey is SJTRSHUEQIZNGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-2-4-6-14(7-5-3-1)16-12-13-8-10-15-11-9-13/h8-11,14,16H,1-7,12H2.
What are the key properties of N-(pyridin-4-ylmethyl)cyclooctanamine?
N-(pyridin-4-ylmethyl)cyclooctanamine has a molecular weight of 218.34 g/mol, XLogP of 3.28, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(pyridin-4-ylmethyl)cyclooctanamine is sourced from PubChem (CID 4722994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).