N-[(4-cyclobutylphenyl)-(6-methyl-2-pyridinyl)methyl]ethanamine

C19H24N2 — CID 116506103

IUPACN-[(4-cyclobutylphenyl)-(6-methyl-2-pyridinyl)methyl]ethanamine
SMILESCCNC(c1ccc(C2CCC2)cc1)c1cccc(C)n1
InChIInChI=1S/C19H24N2/c1-3-20-19(18-9-4-6-14(2)21-18)17-12-10-16(11-13-17)15-7-5-8-15/h4,6,9-13,15,19-20H,3,5,7-8H2,1-2H3
InChIKeyZZCYONXELLAIHS-UHFFFAOYSA-N
MW280.42 g/mol
LogP4.36
Rot. Bonds5

About N-[(4-cyclobutylphenyl)-(6-methyl-2-pyridinyl)methyl]ethanamine

N-[(4-cyclobutylphenyl)-(6-methyl-2-pyridinyl)methyl]ethanamine (PubChem CID 116506103) has the molecular formula C19H24N2 and a molecular weight of 280.42 g/mol. Its IUPAC name is N-[(4-cyclobutylphenyl)-(6-methyl-2-pyridinyl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(4-cyclobutylphenyl)-(6-methyl-2-pyridinyl)methyl]ethanamine
PubChem CID116506103
Molecular FormulaC19H24N2
Molecular Weight280.42 g/mol
Exact Mass280.19
IUPAC NameN-[(4-cyclobutylphenyl)-(6-methyl-2-pyridinyl)methyl]ethanamine
SMILESCCNC(c1ccc(C2CCC2)cc1)c1cccc(C)n1
InChIInChI=1S/C19H24N2/c1-3-20-19(18-9-4-6-14(2)21-18)17-12-10-16(11-13-17)15-7-5-8-15/h4,6,9-13,15,19-20H,3,5,7-8H2,1-2H3
InChIKeyZZCYONXELLAIHS-UHFFFAOYSA-N
XLogP4.36
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(4-ethylphenyl)-(6-methyl-2-pyridinyl)methyl]ethanamine
CID 55221471
N-[(4-cyclobutylphenyl)-(2H-triazol-4-yl)methyl]ethanamine
CID 116506363
N-[(4-cyclobutylphenyl)-pyrimidin-5-ylmethyl]ethanamine
CID 102923880
N-[(3-cyclobutylphenyl)-(4-methylphenyl)methyl]ethanamine
CID 114602617
N-[(3-chloro-2-pyridinyl)-(4-cyclobutylphenyl)methyl]ethanamine
CID 103444478
N-[(4-cyclobutylphenyl)-(3-methylfuran-2-yl)methyl]ethanamine
CID 116506465
N-[(4-cyclobutylphenyl)-(3-fluoro-2-pyridinyl)methyl]ethanamine
CID 116506386
N-[(5-methyl-3-pyridinyl)-(6-methyl-2-pyridinyl)methyl]ethanamine
CID 113297212
N-[(4-cyclobutylphenyl)-(4,5-dimethylthiophen-2-yl)methyl]ethanamine
CID 105044884
N-[(5-bromofuran-2-yl)-(4-cyclobutylphenyl)methyl]ethanamine
CID 105045025
N-[(2,3-dimethylphenyl)-(6-methyl-2-pyridinyl)methyl]ethanamine
CID 63554015
N-[(4-cyclobutylphenyl)-(5-iodothiophen-3-yl)methyl]ethanamine
CID 105044981

Frequently Asked Questions

What is the IUPAC name of N-[(4-cyclobutylphenyl)-(6-methyl-2-pyridinyl)methyl]ethanamine?
The IUPAC name of N-[(4-cyclobutylphenyl)-(6-methyl-2-pyridinyl)methyl]ethanamine (CID 116506103) is N-[(4-cyclobutylphenyl)-(6-methyl-2-pyridinyl)methyl]ethanamine.
What is the SMILES notation for N-[(4-cyclobutylphenyl)-(6-methyl-2-pyridinyl)methyl]ethanamine?
The canonical SMILES for N-[(4-cyclobutylphenyl)-(6-methyl-2-pyridinyl)methyl]ethanamine is CCNC(c1ccc(C2CCC2)cc1)c1cccc(C)n1.
What is the InChIKey of N-[(4-cyclobutylphenyl)-(6-methyl-2-pyridinyl)methyl]ethanamine?
The InChIKey is ZZCYONXELLAIHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2/c1-3-20-19(18-9-4-6-14(2)21-18)17-12-10-16(11-13-17)15-7-5-8-15/h4,6,9-13,15,19-20H,3,5,7-8H2,1-2H3.
What are the key properties of N-[(4-cyclobutylphenyl)-(6-methyl-2-pyridinyl)methyl]ethanamine?
N-[(4-cyclobutylphenyl)-(6-methyl-2-pyridinyl)methyl]ethanamine has a molecular weight of 280.42 g/mol, XLogP of 4.36, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-cyclobutylphenyl)-(6-methyl-2-pyridinyl)methyl]ethanamine is sourced from PubChem (CID 116506103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).