N-[1-(4-butylphenyl)ethyl]-2-methylpyridin-3-amine

C18H24N2 — CID 79041686

IUPACN-[1-(4-butylphenyl)ethyl]-2-methylpyridin-3-amine
SMILESCCCCc1ccc(C(C)Nc2cccnc2C)cc1
InChIInChI=1S/C18H24N2/c1-4-5-7-16-9-11-17(12-10-16)14(2)20-18-8-6-13-19-15(18)3/h6,8-14,20H,4-5,7H2,1-3H3
InChIKeyRMCJYWFRPHPYPH-UHFFFAOYSA-N
MW268.40 g/mol
LogP4.91
Rot. Bonds6

About N-[1-(4-butylphenyl)ethyl]-2-methylpyridin-3-amine

N-[1-(4-butylphenyl)ethyl]-2-methylpyridin-3-amine (PubChem CID 79041686) has the molecular formula C18H24N2 and a molecular weight of 268.40 g/mol. Its IUPAC name is N-[1-(4-butylphenyl)ethyl]-2-methylpyridin-3-amine.

Molecular Properties

Compound NameN-[1-(4-butylphenyl)ethyl]-2-methylpyridin-3-amine
PubChem CID79041686
Molecular FormulaC18H24N2
Molecular Weight268.40 g/mol
Exact Mass268.19
IUPAC NameN-[1-(4-butylphenyl)ethyl]-2-methylpyridin-3-amine
SMILESCCCCc1ccc(C(C)Nc2cccnc2C)cc1
InChIInChI=1S/C18H24N2/c1-4-5-7-16-9-11-17(12-10-16)14(2)20-18-8-6-13-19-15(18)3/h6,8-14,20H,4-5,7H2,1-3H3
InChIKeyRMCJYWFRPHPYPH-UHFFFAOYSA-N
XLogP4.91
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 54.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(4-methoxyphenyl)ethyl]-2-methylpyridin-3-amine
CID 79041915
N-[1-(4-butylphenyl)ethyl]-2,3-dichloroaniline
CID 63421765
2-methyl-N-undecan-6-ylpyridin-3-amine
CID 79042417
N-[1-(4-ethylphenyl)propyl]-2-methylpyridin-3-amine
CID 79041976
1-(4-butylphenyl)-N-(1-pyridin-3-ylethyl)ethanamine
CID 43203644
4-butyl-N-[1-(4-ethylphenyl)ethyl]aniline
CID 43100000
2-methyl-N-[1-(2-methylphenyl)ethyl]pyridin-3-amine
CID 79041978
N-heptan-4-yl-2-methylpyridin-3-amine
CID 79041717
1-(4-butylphenyl)-N-(2-pyridin-4-ylethyl)ethanamine
CID 60903436
2-bromo-N-[1-(4-butylphenyl)ethyl]-5-chloroaniline
CID 81269540
N-(1-ethylsulfonylpropan-2-yl)-2-methylpyridin-3-amine
CID 115922122
1-(4-butylphenyl)-N-(pyridin-4-ylmethyl)ethanamine
CID 43204866

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-butylphenyl)ethyl]-2-methylpyridin-3-amine?
The IUPAC name of N-[1-(4-butylphenyl)ethyl]-2-methylpyridin-3-amine (CID 79041686) is N-[1-(4-butylphenyl)ethyl]-2-methylpyridin-3-amine.
What is the SMILES notation for N-[1-(4-butylphenyl)ethyl]-2-methylpyridin-3-amine?
The canonical SMILES for N-[1-(4-butylphenyl)ethyl]-2-methylpyridin-3-amine is CCCCc1ccc(C(C)Nc2cccnc2C)cc1.
What is the InChIKey of N-[1-(4-butylphenyl)ethyl]-2-methylpyridin-3-amine?
The InChIKey is RMCJYWFRPHPYPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2/c1-4-5-7-16-9-11-17(12-10-16)14(2)20-18-8-6-13-19-15(18)3/h6,8-14,20H,4-5,7H2,1-3H3.
What are the key properties of N-[1-(4-butylphenyl)ethyl]-2-methylpyridin-3-amine?
N-[1-(4-butylphenyl)ethyl]-2-methylpyridin-3-amine has a molecular weight of 268.40 g/mol, XLogP of 4.91, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-butylphenyl)ethyl]-2-methylpyridin-3-amine is sourced from PubChem (CID 79041686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).