1-(2,3-dihydropyridin-4-yl)-N-methylethanamine

C8H14N2 — CID 148929760

IUPAC1-(2,3-dihydropyridin-4-yl)-N-methylethanamine
SMILESCNC(C)C1=CC=NCC1
InChIInChI=1S/C8H14N2/c1-7(9-2)8-3-5-10-6-4-8/h3,5,7,9H,4,6H2,1-2H3
InChIKeyPLSBXYMHUHBJTQ-UHFFFAOYSA-N
MW138.21 g/mol
LogP1.00
Rot. Bonds2

About 1-(2,3-dihydropyridin-4-yl)-N-methylethanamine

1-(2,3-dihydropyridin-4-yl)-N-methylethanamine (PubChem CID 148929760) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is 1-(2,3-dihydropyridin-4-yl)-N-methylethanamine.

Molecular Properties

Compound Name1-(2,3-dihydropyridin-4-yl)-N-methylethanamine
PubChem CID148929760
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Name1-(2,3-dihydropyridin-4-yl)-N-methylethanamine
SMILESCNC(C)C1=CC=NCC1
InChIInChI=1S/C8H14N2/c1-7(9-2)8-3-5-10-6-4-8/h3,5,7,9H,4,6H2,1-2H3
InChIKeyPLSBXYMHUHBJTQ-UHFFFAOYSA-N
XLogP1.00
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(Z)-3-ethyl-4-(methylamino)pent-2-enimidoyl fluoride
CID 146392601
1-(2,3-Dihydropyridin-4-yl)-1,5-diamino-2-pentyne
CID 129705418
1,2,3,5,6,8a-Hexahydro-1,7-naphthyridine
CID 68745150
N-[(2-methyl-2,3-dihydropyridin-4-yl)methyl]ethanamine
CID 89030889
N-[(2-bromo-2,3-dihydropyridin-4-yl)methyl]propan-2-amine
CID 89703399
1,2,3,5,8,8a-Hexahydro-1,6-naphthyridine
CID 90884865
1,2,3,5,8,8a-Hexahydro-1,7-naphthyridine
CID 91132064
1,2,3,7,8,8a-Hexahydro-1,6-naphthyridine
CID 91370128
N-methyl-3-(methyliminomethyl)hex-3-en-2-amine
CID 123203381
2-(2,3-dihydropyridin-2-yl)-N-ethylethanamine
CID 123215911
3-(2,3-dihydropyridin-5-yl)-N-methylpropan-1-amine
CID 123487173
N'-methyl-2-(1,2,3,6-tetrahydropyridin-4-yl)propane-1,3-diimine
CID 123571231

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydropyridin-4-yl)-N-methylethanamine?
The IUPAC name of 1-(2,3-dihydropyridin-4-yl)-N-methylethanamine (CID 148929760) is 1-(2,3-dihydropyridin-4-yl)-N-methylethanamine.
What is the SMILES notation for 1-(2,3-dihydropyridin-4-yl)-N-methylethanamine?
The canonical SMILES for 1-(2,3-dihydropyridin-4-yl)-N-methylethanamine is CNC(C)C1=CC=NCC1.
What is the InChIKey of 1-(2,3-dihydropyridin-4-yl)-N-methylethanamine?
The InChIKey is PLSBXYMHUHBJTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2/c1-7(9-2)8-3-5-10-6-4-8/h3,5,7,9H,4,6H2,1-2H3.
What are the key properties of 1-(2,3-dihydropyridin-4-yl)-N-methylethanamine?
1-(2,3-dihydropyridin-4-yl)-N-methylethanamine has a molecular weight of 138.21 g/mol, XLogP of 1.00, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydropyridin-4-yl)-N-methylethanamine is sourced from PubChem (CID 148929760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).