1-(3-chlorophenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine

C15H17ClN2 — CID 82731318

IUPAC1-(3-chlorophenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine
SMILESCCc1cccnc1C(NC)c1cccc(Cl)c1
InChIInChI=1S/C15H17ClN2/c1-3-11-7-5-9-18-15(11)14(17-2)12-6-4-8-13(16)10-12/h4-10,14,17H,3H2,1-2H3
InChIKeyQIXJNPGRZRGVSQ-UHFFFAOYSA-N
MW260.77 g/mol
LogP3.61
Rot. Bonds4

About 1-(3-chlorophenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine

1-(3-chlorophenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine (PubChem CID 82731318) has the molecular formula C15H17ClN2 and a molecular weight of 260.77 g/mol. Its IUPAC name is 1-(3-chlorophenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(3-chlorophenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine
PubChem CID82731318
Molecular FormulaC15H17ClN2
Molecular Weight260.77 g/mol
Exact Mass260.11
IUPAC Name1-(3-chlorophenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine
SMILESCCc1cccnc1C(NC)c1cccc(Cl)c1
InChIInChI=1S/C15H17ClN2/c1-3-11-7-5-9-18-15(11)14(17-2)12-6-4-8-13(16)10-12/h4-10,14,17H,3H2,1-2H3
InChIKeyQIXJNPGRZRGVSQ-UHFFFAOYSA-N
XLogP3.61
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.77
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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
N-[(3-chlorophenyl)-(3-chloro-2-pyridinyl)methyl]ethanamine
CID 103444575
N-[(3-ethyl-2-pyridinyl)-(3-fluorophenyl)methyl]ethanamine
CID 82731223
1-(3-ethyl-2-pyridinyl)-N-methyl-1-(4-propoxyphenyl)methanamine
CID 82732624
1-(3-ethyl-2-pyridinyl)-N-methyl-1-(5-propoxy-3-pyridinyl)methanamine
CID 82732602
N-[(3-ethyl-2-pyridinyl)-(3-fluorophenyl)methyl]propan-1-amine
CID 82741174
N-[(3-chloro-4-methylphenyl)-(3-ethyl-2-pyridinyl)methyl]ethanamine
CID 107560643
1-(4-chloro-1-ethylpyrazol-5-yl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine
CID 114660043
1-(3-ethyl-2-pyridinyl)-N-methyl-1-(7-methyl-1-benzofuran-2-yl)methanamine
CID 114730705
N-[(3-ethyl-2-pyridinyl)-(4-propan-2-ylphenyl)methyl]ethanamine
CID 82732767
N-[(4-chloro-3-methoxyphenyl)-(3-ethyl-2-pyridinyl)methyl]ethanamine
CID 82732783

Frequently Asked Questions

What is the IUPAC name of 1-(3-chlorophenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine?
The IUPAC name of 1-(3-chlorophenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine (CID 82731318) is 1-(3-chlorophenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine.
What is the SMILES notation for 1-(3-chlorophenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine?
The canonical SMILES for 1-(3-chlorophenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine is CCc1cccnc1C(NC)c1cccc(Cl)c1.
What is the InChIKey of 1-(3-chlorophenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine?
The InChIKey is QIXJNPGRZRGVSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN2/c1-3-11-7-5-9-18-15(11)14(17-2)12-6-4-8-13(16)10-12/h4-10,14,17H,3H2,1-2H3.
What are the key properties of 1-(3-chlorophenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine?
1-(3-chlorophenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine has a molecular weight of 260.77 g/mol, XLogP of 3.61, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chlorophenyl)-1-(3-ethyl-2-pyridinyl)-N-methylmethanamine is sourced from PubChem (CID 82731318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).