(6-ethyl-2-methyl-1,2-dihydropyridin-4-yl)methanamine

C9H16N2 — CID 138702782

IUPAC(6-ethyl-2-methyl-1,2-dihydropyridin-4-yl)methanamine
SMILESCCC1=CC(CN)=CC(C)N1
InChIInChI=1S/C9H16N2/c1-3-9-5-8(6-10)4-7(2)11-9/h4-5,7,11H,3,6,10H2,1-2H3
InChIKeyQHXHCILAKBEMBK-UHFFFAOYSA-N
MW152.24 g/mol
LogP1.16
Rot. Bonds2

About (6-ethyl-2-methyl-1,2-dihydropyridin-4-yl)methanamine

(6-ethyl-2-methyl-1,2-dihydropyridin-4-yl)methanamine (PubChem CID 138702782) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is (6-ethyl-2-methyl-1,2-dihydropyridin-4-yl)methanamine.

Molecular Properties

Compound Name(6-ethyl-2-methyl-1,2-dihydropyridin-4-yl)methanamine
PubChem CID138702782
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC Name(6-ethyl-2-methyl-1,2-dihydropyridin-4-yl)methanamine
SMILESCCC1=CC(CN)=CC(C)N1
InChIInChI=1S/C9H16N2/c1-3-9-5-8(6-10)4-7(2)11-9/h4-5,7,11H,3,6,10H2,1-2H3
InChIKeyQHXHCILAKBEMBK-UHFFFAOYSA-N
XLogP1.16
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (6-ethyl-2-methyl-1,2-dihydropyridin-4-yl)methanamine?
The IUPAC name of (6-ethyl-2-methyl-1,2-dihydropyridin-4-yl)methanamine (CID 138702782) is (6-ethyl-2-methyl-1,2-dihydropyridin-4-yl)methanamine.
What is the SMILES notation for (6-ethyl-2-methyl-1,2-dihydropyridin-4-yl)methanamine?
The canonical SMILES for (6-ethyl-2-methyl-1,2-dihydropyridin-4-yl)methanamine is CCC1=CC(CN)=CC(C)N1.
What is the InChIKey of (6-ethyl-2-methyl-1,2-dihydropyridin-4-yl)methanamine?
The InChIKey is QHXHCILAKBEMBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2/c1-3-9-5-8(6-10)4-7(2)11-9/h4-5,7,11H,3,6,10H2,1-2H3.
What are the key properties of (6-ethyl-2-methyl-1,2-dihydropyridin-4-yl)methanamine?
(6-ethyl-2-methyl-1,2-dihydropyridin-4-yl)methanamine has a molecular weight of 152.24 g/mol, XLogP of 1.16, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6-ethyl-2-methyl-1,2-dihydropyridin-4-yl)methanamine is sourced from PubChem (CID 138702782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).