5-bromo-3-methyl-N-(2-methyl-2-pyridin-2-ylpropyl)pyridin-2-amine

C15H18BrN3 — CID 115148709

IUPAC5-bromo-3-methyl-N-(2-methyl-2-pyridin-2-ylpropyl)pyridin-2-amine
SMILESCc1cc(Br)cnc1NCC(C)(C)c1ccccn1
InChIInChI=1S/C15H18BrN3/c1-11-8-12(16)9-18-14(11)19-10-15(2,3)13-6-4-5-7-17-13/h4-9H,10H2,1-3H3,(H,18,19)
InChIKeyFPLXLKIAOPYAMJ-UHFFFAOYSA-N
MW320.23 g/mol
LogP3.94
Rot. Bonds4

About 5-bromo-3-methyl-N-(2-methyl-2-pyridin-2-ylpropyl)pyridin-2-amine

5-bromo-3-methyl-N-(2-methyl-2-pyridin-2-ylpropyl)pyridin-2-amine (PubChem CID 115148709) has the molecular formula C15H18BrN3 and a molecular weight of 320.23 g/mol. Its IUPAC name is 5-bromo-3-methyl-N-(2-methyl-2-pyridin-2-ylpropyl)pyridin-2-amine.

Molecular Properties

Compound Name5-bromo-3-methyl-N-(2-methyl-2-pyridin-2-ylpropyl)pyridin-2-amine
PubChem CID115148709
Molecular FormulaC15H18BrN3
Molecular Weight320.23 g/mol
Exact Mass319.07
IUPAC Name5-bromo-3-methyl-N-(2-methyl-2-pyridin-2-ylpropyl)pyridin-2-amine
SMILESCc1cc(Br)cnc1NCC(C)(C)c1ccccn1
InChIInChI=1S/C15H18BrN3/c1-11-8-12(16)9-18-14(11)19-10-15(2,3)13-6-4-5-7-17-13/h4-9H,10H2,1-3H3,(H,18,19)
InChIKeyFPLXLKIAOPYAMJ-UHFFFAOYSA-N
XLogP3.94
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.23
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-3-methyl-N-[2-methyl-2-(3-methylthiophen-2-yl)propyl]pyridin-2-amine
CID 115148718
3-[(5-bromo-3-methyl-2-pyridinyl)amino]-2-methylpropane-1,2-diol
CID 79718907
1-N-(5-bromo-3-methyl-2-pyridinyl)-2-ethylbutane-1,2-diamine
CID 115306109
3-[(5-bromo-3-methyl-2-pyridinyl)amino]-2,2-dimethylpropanoic acid
CID 167870567
N-(bromomethyl)-2-methyl-2-pyridin-2-ylpropan-1-amine
CID 115262628
5-bromo-N-[(3-bromophenyl)methyl]-3-methylpyridin-2-amine
CID 79718282
5-bromo-3-methyl-N-(2-methylphenyl)pyridin-2-amine
CID 53410205
3-[[(5-bromo-3-methyl-2-pyridinyl)amino]methyl]-N-methylbenzenesulfonamide
CID 133373833
N-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethyl)-5-bromo-3-methylpyridin-2-amine
CID 79717972
2-methyl-2-N-(2-methyl-2-pyridin-2-ylpropyl)propane-1,2-diamine
CID 115132375
N'-(5-bromo-3-methyl-2-pyridinyl)propane-1,3-diamine
CID 14397364
[3-[[(5-bromo-3-methyl-2-pyridinyl)amino]methyl]phenyl]methanol
CID 79718432

Frequently Asked Questions

What is the IUPAC name of 5-bromo-3-methyl-N-(2-methyl-2-pyridin-2-ylpropyl)pyridin-2-amine?
The IUPAC name of 5-bromo-3-methyl-N-(2-methyl-2-pyridin-2-ylpropyl)pyridin-2-amine (CID 115148709) is 5-bromo-3-methyl-N-(2-methyl-2-pyridin-2-ylpropyl)pyridin-2-amine.
What is the SMILES notation for 5-bromo-3-methyl-N-(2-methyl-2-pyridin-2-ylpropyl)pyridin-2-amine?
The canonical SMILES for 5-bromo-3-methyl-N-(2-methyl-2-pyridin-2-ylpropyl)pyridin-2-amine is Cc1cc(Br)cnc1NCC(C)(C)c1ccccn1.
What is the InChIKey of 5-bromo-3-methyl-N-(2-methyl-2-pyridin-2-ylpropyl)pyridin-2-amine?
The InChIKey is FPLXLKIAOPYAMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18BrN3/c1-11-8-12(16)9-18-14(11)19-10-15(2,3)13-6-4-5-7-17-13/h4-9H,10H2,1-3H3,(H,18,19).
What are the key properties of 5-bromo-3-methyl-N-(2-methyl-2-pyridin-2-ylpropyl)pyridin-2-amine?
5-bromo-3-methyl-N-(2-methyl-2-pyridin-2-ylpropyl)pyridin-2-amine has a molecular weight of 320.23 g/mol, XLogP of 3.94, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-3-methyl-N-(2-methyl-2-pyridin-2-ylpropyl)pyridin-2-amine is sourced from PubChem (CID 115148709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).