1-(3-ethyl-2-pyridinyl)-N-methyl-1-(4-propoxyphenyl)methanamine

C18H24N2O — CID 82732624

IUPAC1-(3-ethyl-2-pyridinyl)-N-methyl-1-(4-propoxyphenyl)methanamine
SMILESCCCOc1ccc(C(NC)c2ncccc2CC)cc1
InChIInChI=1S/C18H24N2O/c1-4-13-21-16-10-8-15(9-11-16)17(19-3)18-14(5-2)7-6-12-20-18/h6-12,17,19H,4-5,13H2,1-3H3
InChIKeyFDURZMVUZNAYFC-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.74
Rot. Bonds7

About 1-(3-ethyl-2-pyridinyl)-N-methyl-1-(4-propoxyphenyl)methanamine

1-(3-ethyl-2-pyridinyl)-N-methyl-1-(4-propoxyphenyl)methanamine (PubChem CID 82732624) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is 1-(3-ethyl-2-pyridinyl)-N-methyl-1-(4-propoxyphenyl)methanamine.

Molecular Properties

Compound Name1-(3-ethyl-2-pyridinyl)-N-methyl-1-(4-propoxyphenyl)methanamine
PubChem CID82732624
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name1-(3-ethyl-2-pyridinyl)-N-methyl-1-(4-propoxyphenyl)methanamine
SMILESCCCOc1ccc(C(NC)c2ncccc2CC)cc1
InChIInChI=1S/C18H24N2O/c1-4-13-21-16-10-8-15(9-11-16)17(19-3)18-14(5-2)7-6-12-20-18/h6-12,17,19H,4-5,13H2,1-3H3
InChIKeyFDURZMVUZNAYFC-UHFFFAOYSA-N
XLogP3.74
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-(3-methyl-2-pyridinyl)-1-(4-propoxyphenyl)methanamine
CID 62796820
1-(3-ethyl-2-pyridinyl)-N-methyl-1-(5-propoxy-3-pyridinyl)methanamine
CID 82732602
1-(3,4-dimethylphenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine
CID 82730774
1-(3-ethyl-2-pyridinyl)-N-methyl-1-thiophen-3-ylmethanamine
CID 82730091
1-(3-chlorophenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine
CID 82731318
N-[(4-propoxyphenyl)-pyrimidin-2-ylmethyl]propan-1-amine
CID 62795433
N-[(3-ethyl-2-pyridinyl)-(4-propan-2-ylphenyl)methyl]ethanamine
CID 82732767
1-(3-chloro-2-pyridinyl)-1-(4-methoxyphenyl)-N-methylmethanamine
CID 103444068
1-(4-ethoxyphenyl)-N-methyl-1-pyridin-2-ylmethanamine
CID 62791020
1-(5-bromothiophen-3-yl)-N-methyl-1-(4-propoxyphenyl)methanamine
CID 105144257
1-(2,3-dichlorophenyl)-N-methyl-1-(4-propoxyphenyl)methanamine
CID 115853395
1-(3-chlorophenyl)-N-methyl-1-(4-propoxyphenyl)methanamine
CID 62795601

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethyl-2-pyridinyl)-N-methyl-1-(4-propoxyphenyl)methanamine?
The IUPAC name of 1-(3-ethyl-2-pyridinyl)-N-methyl-1-(4-propoxyphenyl)methanamine (CID 82732624) is 1-(3-ethyl-2-pyridinyl)-N-methyl-1-(4-propoxyphenyl)methanamine.
What is the SMILES notation for 1-(3-ethyl-2-pyridinyl)-N-methyl-1-(4-propoxyphenyl)methanamine?
The canonical SMILES for 1-(3-ethyl-2-pyridinyl)-N-methyl-1-(4-propoxyphenyl)methanamine is CCCOc1ccc(C(NC)c2ncccc2CC)cc1.
What is the InChIKey of 1-(3-ethyl-2-pyridinyl)-N-methyl-1-(4-propoxyphenyl)methanamine?
The InChIKey is FDURZMVUZNAYFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-4-13-21-16-10-8-15(9-11-16)17(19-3)18-14(5-2)7-6-12-20-18/h6-12,17,19H,4-5,13H2,1-3H3.
What are the key properties of 1-(3-ethyl-2-pyridinyl)-N-methyl-1-(4-propoxyphenyl)methanamine?
1-(3-ethyl-2-pyridinyl)-N-methyl-1-(4-propoxyphenyl)methanamine has a molecular weight of 284.40 g/mol, XLogP of 3.74, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethyl-2-pyridinyl)-N-methyl-1-(4-propoxyphenyl)methanamine is sourced from PubChem (CID 82732624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).