5-bromo-N-(3-ethyl-4-methoxyphenyl)pyridin-2-amine

C14H15BrN2O — CID 115146469

IUPAC5-bromo-N-(3-ethyl-4-methoxyphenyl)pyridin-2-amine
SMILESCCc1cc(Nc2ccc(Br)cn2)ccc1OC
InChIInChI=1S/C14H15BrN2O/c1-3-10-8-12(5-6-13(10)18-2)17-14-7-4-11(15)9-16-14/h4-9H,3H2,1-2H3,(H,16,17)
InChIKeyGUJYXTNUUFYCBX-UHFFFAOYSA-N
MW307.19 g/mol
LogP4.16
Rot. Bonds4

About 5-bromo-N-(3-ethyl-4-methoxyphenyl)pyridin-2-amine

5-bromo-N-(3-ethyl-4-methoxyphenyl)pyridin-2-amine (PubChem CID 115146469) has the molecular formula C14H15BrN2O and a molecular weight of 307.19 g/mol. Its IUPAC name is 5-bromo-N-(3-ethyl-4-methoxyphenyl)pyridin-2-amine.

Molecular Properties

Compound Name5-bromo-N-(3-ethyl-4-methoxyphenyl)pyridin-2-amine
PubChem CID115146469
Molecular FormulaC14H15BrN2O
Molecular Weight307.19 g/mol
Exact Mass306.04
IUPAC Name5-bromo-N-(3-ethyl-4-methoxyphenyl)pyridin-2-amine
SMILESCCc1cc(Nc2ccc(Br)cn2)ccc1OC
InChIInChI=1S/C14H15BrN2O/c1-3-10-8-12(5-6-13(10)18-2)17-14-7-4-11(15)9-16-14/h4-9H,3H2,1-2H3,(H,16,17)
InChIKeyGUJYXTNUUFYCBX-UHFFFAOYSA-N
XLogP4.16
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.19
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-N-(3,4,5-trimethoxyphenyl)pyridin-2-amine
CID 61374133
5-bromo-N-(6-methoxynaphthalen-2-yl)pyridin-2-amine
CID 115146533
5-bromo-N-(6-bromonaphthalen-2-yl)pyridin-2-amine
CID 81260199
N-[3-(chloromethyl)-4-ethoxyphenyl]-5-methoxypyridin-2-amine
CID 106505088
5-bromo-N-[2-(2-methoxy-4,5-dimethylphenyl)ethyl]pyridin-2-amine
CID 115146824
5-chloro-N-(3,4-dimethoxyphenyl)pyridin-2-amine
CID 66218090
5-bromo-N-(5-chloro-2,4-dimethoxyphenyl)pyridin-2-amine
CID 61373201
6-(3-ethyl-4-methoxyanilino)-2-methylpyrimidine-4-carbonitrile
CID 115143180
N-[6-(3,4-dimethoxyanilino)-3-pyridinyl]butanamide
CID 113020075
N-[6-(3-chloro-4-methoxyanilino)-3-pyridinyl]ethanesulfonamide
CID 113019129
5-bromo-N-(3-bromophenyl)pyridin-2-amine
CID 61375271
5-bromo-N-[2-(4-methoxy-3-methylphenyl)ethyl]pyridin-2-amine
CID 115146811

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(3-ethyl-4-methoxyphenyl)pyridin-2-amine?
The IUPAC name of 5-bromo-N-(3-ethyl-4-methoxyphenyl)pyridin-2-amine (CID 115146469) is 5-bromo-N-(3-ethyl-4-methoxyphenyl)pyridin-2-amine.
What is the SMILES notation for 5-bromo-N-(3-ethyl-4-methoxyphenyl)pyridin-2-amine?
The canonical SMILES for 5-bromo-N-(3-ethyl-4-methoxyphenyl)pyridin-2-amine is CCc1cc(Nc2ccc(Br)cn2)ccc1OC.
What is the InChIKey of 5-bromo-N-(3-ethyl-4-methoxyphenyl)pyridin-2-amine?
The InChIKey is GUJYXTNUUFYCBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15BrN2O/c1-3-10-8-12(5-6-13(10)18-2)17-14-7-4-11(15)9-16-14/h4-9H,3H2,1-2H3,(H,16,17).
What are the key properties of 5-bromo-N-(3-ethyl-4-methoxyphenyl)pyridin-2-amine?
5-bromo-N-(3-ethyl-4-methoxyphenyl)pyridin-2-amine has a molecular weight of 307.19 g/mol, XLogP of 4.16, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(3-ethyl-4-methoxyphenyl)pyridin-2-amine is sourced from PubChem (CID 115146469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).