N-ethyl-2-(3-methyl-2-pyridinyl)-1-(1-phenylcyclopropyl)ethanamine

C19H24N2 — CID 66447860

IUPACN-ethyl-2-(3-methyl-2-pyridinyl)-1-(1-phenylcyclopropyl)ethanamine
SMILESCCNC(Cc1ncccc1C)C1(c2ccccc2)CC1
InChIInChI=1S/C19H24N2/c1-3-20-18(14-17-15(2)8-7-13-21-17)19(11-12-19)16-9-5-4-6-10-16/h4-10,13,18,20H,3,11-12,14H2,1-2H3
InChIKeyZJOQKAYDFKQMEW-UHFFFAOYSA-N
MW280.41 g/mol
LogP3.64
Rot. Bonds6

About N-ethyl-2-(3-methyl-2-pyridinyl)-1-(1-phenylcyclopropyl)ethanamine

N-ethyl-2-(3-methyl-2-pyridinyl)-1-(1-phenylcyclopropyl)ethanamine (PubChem CID 66447860) has the molecular formula C19H24N2 and a molecular weight of 280.41 g/mol. Its IUPAC name is N-ethyl-2-(3-methyl-2-pyridinyl)-1-(1-phenylcyclopropyl)ethanamine.

Molecular Properties

Compound NameN-ethyl-2-(3-methyl-2-pyridinyl)-1-(1-phenylcyclopropyl)ethanamine
PubChem CID66447860
Molecular FormulaC19H24N2
Molecular Weight280.41 g/mol
Exact Mass280.19
IUPAC NameN-ethyl-2-(3-methyl-2-pyridinyl)-1-(1-phenylcyclopropyl)ethanamine
SMILESCCNC(Cc1ncccc1C)C1(c2ccccc2)CC1
InChIInChI=1S/C19H24N2/c1-3-20-18(14-17-15(2)8-7-13-21-17)19(11-12-19)16-9-5-4-6-10-16/h4-10,13,18,20H,3,11-12,14H2,1-2H3
InChIKeyZJOQKAYDFKQMEW-UHFFFAOYSA-N
XLogP3.64
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.41
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(3-methyl-2-pyridinyl)-1-(1-phenylcyclopropyl)ethanamine?
The IUPAC name of N-ethyl-2-(3-methyl-2-pyridinyl)-1-(1-phenylcyclopropyl)ethanamine (CID 66447860) is N-ethyl-2-(3-methyl-2-pyridinyl)-1-(1-phenylcyclopropyl)ethanamine.
What is the SMILES notation for N-ethyl-2-(3-methyl-2-pyridinyl)-1-(1-phenylcyclopropyl)ethanamine?
The canonical SMILES for N-ethyl-2-(3-methyl-2-pyridinyl)-1-(1-phenylcyclopropyl)ethanamine is CCNC(Cc1ncccc1C)C1(c2ccccc2)CC1.
What is the InChIKey of N-ethyl-2-(3-methyl-2-pyridinyl)-1-(1-phenylcyclopropyl)ethanamine?
The InChIKey is ZJOQKAYDFKQMEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2/c1-3-20-18(14-17-15(2)8-7-13-21-17)19(11-12-19)16-9-5-4-6-10-16/h4-10,13,18,20H,3,11-12,14H2,1-2H3.
What are the key properties of N-ethyl-2-(3-methyl-2-pyridinyl)-1-(1-phenylcyclopropyl)ethanamine?
N-ethyl-2-(3-methyl-2-pyridinyl)-1-(1-phenylcyclopropyl)ethanamine has a molecular weight of 280.41 g/mol, XLogP of 3.64, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(3-methyl-2-pyridinyl)-1-(1-phenylcyclopropyl)ethanamine is sourced from PubChem (CID 66447860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).