5-(2-ethylazepan-1-yl)-N-methylpyridin-3-amine

C14H23N3 — CID 113442062

IUPAC5-(2-ethylazepan-1-yl)-N-methylpyridin-3-amine
SMILESCCC1CCCCCN1c1cncc(NC)c1
InChIInChI=1S/C14H23N3/c1-3-13-7-5-4-6-8-17(13)14-9-12(15-2)10-16-11-14/h9-11,13,15H,3-8H2,1-2H3
InChIKeyPHVUHURQYOFKTL-UHFFFAOYSA-N
MW233.36 g/mol
LogP3.28
Rot. Bonds3

About 5-(2-ethylazepan-1-yl)-N-methylpyridin-3-amine

5-(2-ethylazepan-1-yl)-N-methylpyridin-3-amine (PubChem CID 113442062) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is 5-(2-ethylazepan-1-yl)-N-methylpyridin-3-amine.

Molecular Properties

Compound Name5-(2-ethylazepan-1-yl)-N-methylpyridin-3-amine
PubChem CID113442062
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC Name5-(2-ethylazepan-1-yl)-N-methylpyridin-3-amine
SMILESCCC1CCCCCN1c1cncc(NC)c1
InChIInChI=1S/C14H23N3/c1-3-13-7-5-4-6-8-17(13)14-9-12(15-2)10-16-11-14/h9-11,13,15H,3-8H2,1-2H3
InChIKeyPHVUHURQYOFKTL-UHFFFAOYSA-N
XLogP3.28
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[1-[5-(methylamino)-3-pyridinyl]piperidin-2-yl]propan-2-ol
CID 112748835
N-methyl-5-(2-methylpiperidin-1-yl)pyridin-3-amine
CID 104532444
3-bromo-5-(2-ethylpyrrolidin-1-yl)pyridine
CID 104531587
N-cyclopentyl-5-(2-ethylpiperidin-1-yl)pyridine-3-carboxamide
CID 109225954
5-(2-ethylpiperidin-1-yl)-N-(4-piperidin-1-ylphenyl)pyridine-3-carboxamide
CID 109240663
N-[4-(diethylamino)phenyl]-5-(2-ethylpiperidin-1-yl)pyridine-3-carboxamide
CID 109240661
5-(2-ethylpiperidin-1-yl)-N-(3-methylbutyl)pyridine-3-carboxamide
CID 109239784
2-ethyl-1-(4-methylphenyl)piperidine
CID 90712958
N-benzyl-5-(2-ethylpiperidin-1-yl)pyridine-3-carboxamide
CID 109231683
N-(2,6-dimethylphenyl)-5-(2-ethylpiperidin-1-yl)pyridine-3-carboxamide
CID 109240615
[5-(2-ethylpiperidin-1-yl)-3-pyridinyl]-(3-methylpiperidin-1-yl)methanone
CID 109240600
5-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-N-ethylpyridin-3-amine
CID 102729180

Frequently Asked Questions

What is the IUPAC name of 5-(2-ethylazepan-1-yl)-N-methylpyridin-3-amine?
The IUPAC name of 5-(2-ethylazepan-1-yl)-N-methylpyridin-3-amine (CID 113442062) is 5-(2-ethylazepan-1-yl)-N-methylpyridin-3-amine.
What is the SMILES notation for 5-(2-ethylazepan-1-yl)-N-methylpyridin-3-amine?
The canonical SMILES for 5-(2-ethylazepan-1-yl)-N-methylpyridin-3-amine is CCC1CCCCCN1c1cncc(NC)c1.
What is the InChIKey of 5-(2-ethylazepan-1-yl)-N-methylpyridin-3-amine?
The InChIKey is PHVUHURQYOFKTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-3-13-7-5-4-6-8-17(13)14-9-12(15-2)10-16-11-14/h9-11,13,15H,3-8H2,1-2H3.
What are the key properties of 5-(2-ethylazepan-1-yl)-N-methylpyridin-3-amine?
5-(2-ethylazepan-1-yl)-N-methylpyridin-3-amine has a molecular weight of 233.36 g/mol, XLogP of 3.28, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-ethylazepan-1-yl)-N-methylpyridin-3-amine is sourced from PubChem (CID 113442062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).