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

Trovirdine
CID 3000870
Thiourea, N-(5-bromo-2-pyridinyl)-N'-(2-phenylethyl)-
CID 2429552
Trovirdine hydrochloride
CID 5327620
PETT deriv. 6
CID 492697
AS1535907
CID 10200069
4-Methyl-6-(2-(5-(3-(Methylamino)propyl)pyridin-3-Yl)ethyl)pyridin-2-Amine
CID 119081688
6-Methyl-N4-(pyridin-3-ylmethyl)pyrimidine-2,4-diamine
CID 2725571
Thiourea, N-(3-bromo-2-pyridinyl)-N'-(2-phenylethyl)-
CID 3001118
Thiourea, N-(5-methyl-2-pyridinyl)-N'-(2-(2-pyridinyl)ethyl)-
CID 3001124
N-(4-bromobenzyl)-6-methylpyridin-2-amine
CID 975979
1-(5-bromo-2-pyridyl)-3-[(1R)-1-phenylethyl]thiourea
CID 3002360
N'-[7-(4-bromophenyl)-1,6-naphthyridin-5-yl]propane-1,3-diamine
CID 10193693

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).