5-bromo-N-(2-methyl-6-propan-2-ylphenyl)pyridin-2-amine

C15H17BrN2 — CID 63463659

IUPAC5-bromo-N-(2-methyl-6-propan-2-ylphenyl)pyridin-2-amine
SMILESCc1cccc(C(C)C)c1Nc1ccc(Br)cn1
InChIInChI=1S/C15H17BrN2/c1-10(2)13-6-4-5-11(3)15(13)18-14-8-7-12(16)9-17-14/h4-10H,1-3H3,(H,17,18)
InChIKeyMIWRIGWTGAWEMI-UHFFFAOYSA-N
MW305.22 g/mol
LogP5.02
Rot. Bonds3

About 5-bromo-N-(2-methyl-6-propan-2-ylphenyl)pyridin-2-amine

5-bromo-N-(2-methyl-6-propan-2-ylphenyl)pyridin-2-amine (PubChem CID 63463659) has the molecular formula C15H17BrN2 and a molecular weight of 305.22 g/mol. Its IUPAC name is 5-bromo-N-(2-methyl-6-propan-2-ylphenyl)pyridin-2-amine.

Molecular Properties

Compound Name5-bromo-N-(2-methyl-6-propan-2-ylphenyl)pyridin-2-amine
PubChem CID63463659
Molecular FormulaC15H17BrN2
Molecular Weight305.22 g/mol
Exact Mass304.06
IUPAC Name5-bromo-N-(2-methyl-6-propan-2-ylphenyl)pyridin-2-amine
SMILESCc1cccc(C(C)C)c1Nc1ccc(Br)cn1
InChIInChI=1S/C15H17BrN2/c1-10(2)13-6-4-5-11(3)15(13)18-14-8-7-12(16)9-17-14/h4-10H,1-3H3,(H,17,18)
InChIKeyMIWRIGWTGAWEMI-UHFFFAOYSA-N
XLogP5.02
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500305.22
LogP ≤ 55.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-N-(2-methyl-6-propan-2-ylphenyl)pyridin-2-amine
CID 66234324
5-bromo-N-(2-chloro-6-methylphenyl)pyridin-2-amine
CID 66255644
N-[6-(2-methyl-6-propan-2-ylanilino)-3-pyridinyl]propane-1-sulfonamide
CID 113018038
3-methyl-N-[6-(2-methyl-6-propan-2-ylanilino)-3-pyridinyl]butanamide
CID 113018002
N-(5-bromo-2-pyridinyl)-1-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl]piperidine-4-carboxamide
CID 55816727
1-cyclopropyl-3-[6-(2-methyl-6-propan-2-ylanilino)-3-pyridinyl]urea
CID 113018035
N-butyl-6-(2-methyl-6-propan-2-ylanilino)pyridine-3-carboxamide
CID 109151740
3-N-(3-bromophenyl)-5-N-(2-methyl-6-propan-2-ylphenyl)-1,2,4-triazine-3,5-diamine
CID 112965107
4-bromo-2-(2-methyl-6-propan-2-ylanilino)benzenecarbothioamide
CID 114902647
N-[5-(2-methyl-6-propan-2-ylanilino)-2-pyridinyl]butanamide
CID 113032871
methyl N-[6-(2-methyl-6-propan-2-ylanilino)pyridazin-3-yl]carbamate
CID 113047064
ethyl N-[5-(2-methyl-6-propan-2-ylanilino)-2-pyridinyl]carbamate
CID 113032879

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(2-methyl-6-propan-2-ylphenyl)pyridin-2-amine?
The IUPAC name of 5-bromo-N-(2-methyl-6-propan-2-ylphenyl)pyridin-2-amine (CID 63463659) is 5-bromo-N-(2-methyl-6-propan-2-ylphenyl)pyridin-2-amine.
What is the SMILES notation for 5-bromo-N-(2-methyl-6-propan-2-ylphenyl)pyridin-2-amine?
The canonical SMILES for 5-bromo-N-(2-methyl-6-propan-2-ylphenyl)pyridin-2-amine is Cc1cccc(C(C)C)c1Nc1ccc(Br)cn1.
What is the InChIKey of 5-bromo-N-(2-methyl-6-propan-2-ylphenyl)pyridin-2-amine?
The InChIKey is MIWRIGWTGAWEMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17BrN2/c1-10(2)13-6-4-5-11(3)15(13)18-14-8-7-12(16)9-17-14/h4-10H,1-3H3,(H,17,18).
What are the key properties of 5-bromo-N-(2-methyl-6-propan-2-ylphenyl)pyridin-2-amine?
5-bromo-N-(2-methyl-6-propan-2-ylphenyl)pyridin-2-amine has a molecular weight of 305.22 g/mol, XLogP of 5.02, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(2-methyl-6-propan-2-ylphenyl)pyridin-2-amine is sourced from PubChem (CID 63463659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).