5-bromo-N-ethyl-6-methyl-N-(piperidin-2-ylmethyl)pyridin-2-amine

C14H22BrN3 — CID 114046810

IUPAC5-bromo-N-ethyl-6-methyl-N-(piperidin-2-ylmethyl)pyridin-2-amine
SMILESCCN(CC1CCCCN1)c1ccc(Br)c(C)n1
InChIInChI=1S/C14H22BrN3/c1-3-18(10-12-6-4-5-9-16-12)14-8-7-13(15)11(2)17-14/h7-8,12,16H,3-6,9-10H2,1-2H3
InChIKeyHZYVTZNRNUWHQT-UHFFFAOYSA-N
MW312.25 g/mol
LogP3.12
Rot. Bonds4

About 5-bromo-N-ethyl-6-methyl-N-(piperidin-2-ylmethyl)pyridin-2-amine

5-bromo-N-ethyl-6-methyl-N-(piperidin-2-ylmethyl)pyridin-2-amine (PubChem CID 114046810) has the molecular formula C14H22BrN3 and a molecular weight of 312.25 g/mol. Its IUPAC name is 5-bromo-N-ethyl-6-methyl-N-(piperidin-2-ylmethyl)pyridin-2-amine.

Molecular Properties

Compound Name5-bromo-N-ethyl-6-methyl-N-(piperidin-2-ylmethyl)pyridin-2-amine
PubChem CID114046810
Molecular FormulaC14H22BrN3
Molecular Weight312.25 g/mol
Exact Mass311.10
IUPAC Name5-bromo-N-ethyl-6-methyl-N-(piperidin-2-ylmethyl)pyridin-2-amine
SMILESCCN(CC1CCCCN1)c1ccc(Br)c(C)n1
InChIInChI=1S/C14H22BrN3/c1-3-18(10-12-6-4-5-9-16-12)14-8-7-13(15)11(2)17-14/h7-8,12,16H,3-6,9-10H2,1-2H3
InChIKeyHZYVTZNRNUWHQT-UHFFFAOYSA-N
XLogP3.12
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.25
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-6-methyl-N-(pyrrolidin-2-ylmethyl)pyridin-2-amine
CID 106619421
6-N-ethyl-3-nitro-6-N-(piperidin-2-ylmethyl)pyridine-2,6-diamine
CID 106641902
N-(azocan-2-ylmethyl)-N-ethylaniline
CID 114240324
2-bromo-6-[ethyl(piperidin-2-ylmethyl)amino]benzonitrile
CID 106641728
N-ethyl-N-(piperidin-2-ylmethyl)-4,5-dihydro-1H-imidazol-2-amine
CID 106632658
3-bromo-4-[ethyl(piperidin-2-ylmethyl)amino]benzamide
CID 106641907
4,6-dimethyl-N-(piperidin-2-ylmethyl)-N-propylpyrimidin-2-amine
CID 106642566
N-ethyl-N-(piperidin-2-ylmethyl)quinazolin-2-amine
CID 106641730
6-[ethyl(pyrrolidin-2-ylmethyl)amino]pyridine-3-carbonitrile
CID 106619350
N-ethyl-2-methyl-N-[[(2S)-pyrrolidin-2-yl]methyl]aniline
CID 28598067
4-bromo-N-ethyl-N-(piperidin-2-ylmethyl)-2-(trifluoromethyl)aniline
CID 106641749
5,6-dimethyl-N-(piperidin-2-ylmethyl)-N-propyl-1,2,4-triazin-3-amine
CID 106642559

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-ethyl-6-methyl-N-(piperidin-2-ylmethyl)pyridin-2-amine?
The IUPAC name of 5-bromo-N-ethyl-6-methyl-N-(piperidin-2-ylmethyl)pyridin-2-amine (CID 114046810) is 5-bromo-N-ethyl-6-methyl-N-(piperidin-2-ylmethyl)pyridin-2-amine.
What is the SMILES notation for 5-bromo-N-ethyl-6-methyl-N-(piperidin-2-ylmethyl)pyridin-2-amine?
The canonical SMILES for 5-bromo-N-ethyl-6-methyl-N-(piperidin-2-ylmethyl)pyridin-2-amine is CCN(CC1CCCCN1)c1ccc(Br)c(C)n1.
What is the InChIKey of 5-bromo-N-ethyl-6-methyl-N-(piperidin-2-ylmethyl)pyridin-2-amine?
The InChIKey is HZYVTZNRNUWHQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22BrN3/c1-3-18(10-12-6-4-5-9-16-12)14-8-7-13(15)11(2)17-14/h7-8,12,16H,3-6,9-10H2,1-2H3.
What are the key properties of 5-bromo-N-ethyl-6-methyl-N-(piperidin-2-ylmethyl)pyridin-2-amine?
5-bromo-N-ethyl-6-methyl-N-(piperidin-2-ylmethyl)pyridin-2-amine has a molecular weight of 312.25 g/mol, XLogP of 3.12, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-ethyl-6-methyl-N-(piperidin-2-ylmethyl)pyridin-2-amine is sourced from PubChem (CID 114046810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).