5-bromo-4-methyl-N-(2-morpholin-4-ylethyl)pyridin-2-amine

C12H18BrN3O — CID 113340018

IUPAC5-bromo-4-methyl-N-(2-morpholin-4-ylethyl)pyridin-2-amine
SMILESCc1cc(NCCN2CCOCC2)ncc1Br
InChIInChI=1S/C12H18BrN3O/c1-10-8-12(15-9-11(10)13)14-2-3-16-4-6-17-7-5-16/h8-9H,2-7H2,1H3,(H,14,15)
InChIKeyNIYDNLUCSNHYGR-UHFFFAOYSA-N
MW300.20 g/mol
LogP1.90
Rot. Bonds4

About 5-bromo-4-methyl-N-(2-morpholin-4-ylethyl)pyridin-2-amine

5-bromo-4-methyl-N-(2-morpholin-4-ylethyl)pyridin-2-amine (PubChem CID 113340018) has the molecular formula C12H18BrN3O and a molecular weight of 300.20 g/mol. Its IUPAC name is 5-bromo-4-methyl-N-(2-morpholin-4-ylethyl)pyridin-2-amine.

Molecular Properties

Compound Name5-bromo-4-methyl-N-(2-morpholin-4-ylethyl)pyridin-2-amine
PubChem CID113340018
Molecular FormulaC12H18BrN3O
Molecular Weight300.20 g/mol
Exact Mass299.06
IUPAC Name5-bromo-4-methyl-N-(2-morpholin-4-ylethyl)pyridin-2-amine
SMILESCc1cc(NCCN2CCOCC2)ncc1Br
InChIInChI=1S/C12H18BrN3O/c1-10-8-12(15-9-11(10)13)14-2-3-16-4-6-17-7-5-16/h8-9H,2-7H2,1H3,(H,14,15)
InChIKeyNIYDNLUCSNHYGR-UHFFFAOYSA-N
XLogP1.90
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.20
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-4-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]pyridin-2-amine
CID 113340028
5-methyl-N-(2-morpholin-4-ylethyl)pyridin-2-amine
CID 23551658
3-bromo-4-methyl-N-(2-morpholin-4-ylethyl)aniline
CID 39420305
4-N-(4-bromo-2-methylphenyl)-6-N-(2-morpholin-4-ylethyl)pyrimidine-4,6-diamine
CID 112857691
4-methyl-N-(3-morpholin-4-ylpropyl)-5-nitropyridin-2-amine
CID 79173434
4-(3-bromo-4-methylanilino)-6-(2-morpholin-4-ylethylamino)-1,7-naphthyridine-3-carbonitrile
CID 69315031
6-methyl-4-N-(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine
CID 67328297
N'-(5-bromo-4-methyl-2-pyridinyl)butane-1,4-diamine
CID 114869070
[4-[[(5-bromo-4-methyl-2-pyridinyl)amino]methyl]oxan-4-yl]methanol
CID 86781248
2-N-(2-bromophenyl)-6-methyl-4-N-(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine
CID 112913247
5-methyl-N-(2-morpholin-4-ylethyl)-6-phenylpyridazin-3-amine
CID 13218688
5-bromo-4-N-(2-morpholin-4-ylethyl)-2-N-propylpyrimidine-2,4-diamine
CID 80776953

Frequently Asked Questions

What is the IUPAC name of 5-bromo-4-methyl-N-(2-morpholin-4-ylethyl)pyridin-2-amine?
The IUPAC name of 5-bromo-4-methyl-N-(2-morpholin-4-ylethyl)pyridin-2-amine (CID 113340018) is 5-bromo-4-methyl-N-(2-morpholin-4-ylethyl)pyridin-2-amine.
What is the SMILES notation for 5-bromo-4-methyl-N-(2-morpholin-4-ylethyl)pyridin-2-amine?
The canonical SMILES for 5-bromo-4-methyl-N-(2-morpholin-4-ylethyl)pyridin-2-amine is Cc1cc(NCCN2CCOCC2)ncc1Br.
What is the InChIKey of 5-bromo-4-methyl-N-(2-morpholin-4-ylethyl)pyridin-2-amine?
The InChIKey is NIYDNLUCSNHYGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18BrN3O/c1-10-8-12(15-9-11(10)13)14-2-3-16-4-6-17-7-5-16/h8-9H,2-7H2,1H3,(H,14,15).
What are the key properties of 5-bromo-4-methyl-N-(2-morpholin-4-ylethyl)pyridin-2-amine?
5-bromo-4-methyl-N-(2-morpholin-4-ylethyl)pyridin-2-amine has a molecular weight of 300.20 g/mol, XLogP of 1.90, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-4-methyl-N-(2-morpholin-4-ylethyl)pyridin-2-amine is sourced from PubChem (CID 113340018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).