N-(pyridin-2-ylmethyl)octan-2-amine

C14H24N2 — CID 43085262

IUPACN-(pyridin-2-ylmethyl)octan-2-amine
SMILESCCCCCCC(C)NCc1ccccn1
InChIInChI=1S/C14H24N2/c1-3-4-5-6-9-13(2)16-12-14-10-7-8-11-15-14/h7-8,10-11,13,16H,3-6,9,12H2,1-2H3
InChIKeyDEEKWKGCEZGPQT-UHFFFAOYSA-N
MW220.36 g/mol
LogP3.53
Rot. Bonds8

About N-(pyridin-2-ylmethyl)octan-2-amine

N-(pyridin-2-ylmethyl)octan-2-amine (PubChem CID 43085262) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is N-(pyridin-2-ylmethyl)octan-2-amine.

Molecular Properties

Compound NameN-(pyridin-2-ylmethyl)octan-2-amine
PubChem CID43085262
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC NameN-(pyridin-2-ylmethyl)octan-2-amine
SMILESCCCCCCC(C)NCc1ccccn1
InChIInChI=1S/C14H24N2/c1-3-4-5-6-9-13(2)16-12-14-10-7-8-11-15-14/h7-8,10-11,13,16H,3-6,9,12H2,1-2H3
InChIKeyDEEKWKGCEZGPQT-UHFFFAOYSA-N
XLogP3.53
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(pyridazin-3-ylmethyl)heptan-2-amine
CID 106895304
2-methyl-1-octan-2-yl-3-(pyridin-2-ylmethyl)guanidine
CID 111212533
1-ethylsulfonyl-N-(pyridin-2-ylmethyl)propan-2-amine
CID 115626100
2-[(heptan-2-ylamino)methyl]pyridin-3-amine
CID 104739927
N-[(5-chloro-2-pyridinyl)methyl]heptan-2-amine
CID 115906670
N-benzylnonadecan-2-amine;hydrochloride
CID 173191574
N-(pyridin-2-ylmethyl)hex-5-en-2-amine
CID 75525482
(2R)-N-benzylheptan-2-amine
CID 14923313
1-N,2-N,2-N-tris(pyridin-2-ylmethyl)decane-1,2-diamine
CID 91282889
2-(2-chlorononyl)pyridine
CID 66459167
2-(2-bromodecyl)pyridine
CID 66452883
2-(3-methyloctyl)pyridine;hydrochloride
CID 172780204

Frequently Asked Questions

What is the IUPAC name of N-(pyridin-2-ylmethyl)octan-2-amine?
The IUPAC name of N-(pyridin-2-ylmethyl)octan-2-amine (CID 43085262) is N-(pyridin-2-ylmethyl)octan-2-amine.
What is the SMILES notation for N-(pyridin-2-ylmethyl)octan-2-amine?
The canonical SMILES for N-(pyridin-2-ylmethyl)octan-2-amine is CCCCCCC(C)NCc1ccccn1.
What is the InChIKey of N-(pyridin-2-ylmethyl)octan-2-amine?
The InChIKey is DEEKWKGCEZGPQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2/c1-3-4-5-6-9-13(2)16-12-14-10-7-8-11-15-14/h7-8,10-11,13,16H,3-6,9,12H2,1-2H3.
What are the key properties of N-(pyridin-2-ylmethyl)octan-2-amine?
N-(pyridin-2-ylmethyl)octan-2-amine has a molecular weight of 220.36 g/mol, XLogP of 3.53, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(pyridin-2-ylmethyl)octan-2-amine is sourced from PubChem (CID 43085262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).