N-ethyl-1-pyridin-2-ylnonan-1-amine

C16H28N2 — CID 62600129

IUPACN-ethyl-1-pyridin-2-ylnonan-1-amine
SMILESCCCCCCCCC(NCC)c1ccccn1
InChIInChI=1S/C16H28N2/c1-3-5-6-7-8-9-12-15(17-4-2)16-13-10-11-14-18-16/h10-11,13-15,17H,3-9,12H2,1-2H3
InChIKeyHXWXRUYVFCXJGS-UHFFFAOYSA-N
MW248.41 g/mol
LogP4.48
Rot. Bonds10

About N-ethyl-1-pyridin-2-ylnonan-1-amine

N-ethyl-1-pyridin-2-ylnonan-1-amine (PubChem CID 62600129) has the molecular formula C16H28N2 and a molecular weight of 248.41 g/mol. Its IUPAC name is N-ethyl-1-pyridin-2-ylnonan-1-amine.

Molecular Properties

Compound NameN-ethyl-1-pyridin-2-ylnonan-1-amine
PubChem CID62600129
Molecular FormulaC16H28N2
Molecular Weight248.41 g/mol
Exact Mass248.23
IUPAC NameN-ethyl-1-pyridin-2-ylnonan-1-amine
SMILESCCCCCCCCC(NCC)c1ccccn1
InChIInChI=1S/C16H28N2/c1-3-5-6-7-8-9-12-15(17-4-2)16-13-10-11-14-18-16/h10-11,13-15,17H,3-9,12H2,1-2H3
InChIKeyHXWXRUYVFCXJGS-UHFFFAOYSA-N
XLogP4.48
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.41
LogP ≤ 54.48
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-ethyl-1-pyridin-2-ylhexan-1-amine
CID 62600130
1-pyridin-2-yloctylhydrazine
CID 105195796
N-ethyl-5-methyl-1-pyridin-2-ylhexan-1-amine
CID 83161018
N-ethyl-1-(4-methyl-2-pyridinyl)undecan-1-amine
CID 63839591
2-tridecan-6-ylpyridine
CID 139295924
N-ethyl-4,4-dimethyl-1-pyridin-2-ylpentan-1-amine
CID 62602048
N-(1-pyridin-2-yltridecyl)benzenesulfonamide
CID 54173262
N-propyl-1-pyridin-2-yloct-7-en-1-amine
CID 107008851
N-ethyl-1-[2-[1-(ethylamino)tridecyl]phenyl]tridecan-1-amine
CID 57251881
N-ethyl-1-(2-methylpyrimidin-4-yl)heptan-1-amine
CID 113329619
2-decan-4-ylpyridine
CID 67882797
N-ethyl-3-methyl-1-pyridin-2-ylbut-3-en-1-amine
CID 79178919

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-pyridin-2-ylnonan-1-amine?
The IUPAC name of N-ethyl-1-pyridin-2-ylnonan-1-amine (CID 62600129) is N-ethyl-1-pyridin-2-ylnonan-1-amine.
What is the SMILES notation for N-ethyl-1-pyridin-2-ylnonan-1-amine?
The canonical SMILES for N-ethyl-1-pyridin-2-ylnonan-1-amine is CCCCCCCCC(NCC)c1ccccn1.
What is the InChIKey of N-ethyl-1-pyridin-2-ylnonan-1-amine?
The InChIKey is HXWXRUYVFCXJGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2/c1-3-5-6-7-8-9-12-15(17-4-2)16-13-10-11-14-18-16/h10-11,13-15,17H,3-9,12H2,1-2H3.
What are the key properties of N-ethyl-1-pyridin-2-ylnonan-1-amine?
N-ethyl-1-pyridin-2-ylnonan-1-amine has a molecular weight of 248.41 g/mol, XLogP of 4.48, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-pyridin-2-ylnonan-1-amine is sourced from PubChem (CID 62600129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).