5-(bromomethyl)-N,3-dimethyl-N-(2-methylcyclohexyl)pyridin-2-amine

C15H23BrN2 — CID 107082051

IUPAC5-(bromomethyl)-N,3-dimethyl-N-(2-methylcyclohexyl)pyridin-2-amine
SMILESCc1cc(CBr)cnc1N(C)C1CCCCC1C
InChIInChI=1S/C15H23BrN2/c1-11-6-4-5-7-14(11)18(3)15-12(2)8-13(9-16)10-17-15/h8,10-11,14H,4-7,9H2,1-3H3
InChIKeyOYJIAQWBMDBJFP-UHFFFAOYSA-N
MW311.27 g/mol
LogP4.30
Rot. Bonds3

About 5-(bromomethyl)-N,3-dimethyl-N-(2-methylcyclohexyl)pyridin-2-amine

5-(bromomethyl)-N,3-dimethyl-N-(2-methylcyclohexyl)pyridin-2-amine (PubChem CID 107082051) has the molecular formula C15H23BrN2 and a molecular weight of 311.27 g/mol. Its IUPAC name is 5-(bromomethyl)-N,3-dimethyl-N-(2-methylcyclohexyl)pyridin-2-amine.

Molecular Properties

Compound Name5-(bromomethyl)-N,3-dimethyl-N-(2-methylcyclohexyl)pyridin-2-amine
PubChem CID107082051
Molecular FormulaC15H23BrN2
Molecular Weight311.27 g/mol
Exact Mass310.10
IUPAC Name5-(bromomethyl)-N,3-dimethyl-N-(2-methylcyclohexyl)pyridin-2-amine
SMILESCc1cc(CBr)cnc1N(C)C1CCCCC1C
InChIInChI=1S/C15H23BrN2/c1-11-6-4-5-7-14(11)18(3)15-12(2)8-13(9-16)10-17-15/h8,10-11,14H,4-7,9H2,1-3H3
InChIKeyOYJIAQWBMDBJFP-UHFFFAOYSA-N
XLogP4.30
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.27
LogP ≤ 54.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

5-(bromomethyl)-N-cyclohexyl-N,3-dimethylpyridin-2-amine
CID 107079358
5-methyl-6-[methyl-(2-methylcyclohexyl)amino]pyridine-3-carboxylic acid
CID 80632415
[5-chloro-6-[methyl-(2-methylcyclohexyl)amino]-3-pyridinyl]methanol
CID 55005290
3-chloro-N-methyl-5-(methylaminomethyl)-N-(2-methylcyclohexyl)pyridin-2-amine
CID 62288638
3-bromo-2-N-methyl-2-N-(2-methylcyclohexyl)pyridine-2,5-diamine
CID 79535351
3-chloro-N-methyl-N-(2-methylcyclohexyl)-5-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 62288457
5-(bromomethyl)-N,3-dimethyl-N-(oxolan-2-ylmethyl)pyridin-2-amine
CID 107081226
5-(chloromethyl)-N-cyclohexyl-N,3-dimethylpyridin-2-amine
CID 80627987
5-(bromomethyl)-N-cyclopropyl-3-methyl-N-(thiophen-3-ylmethyl)pyridin-2-amine
CID 107081264
3-chloro-2-N-methyl-2-N-(2-methylcyclohexyl)pyridine-2,5-diamine
CID 114046172
5-bromo-3-(ethylaminomethyl)-N-methyl-N-(2-methylcyclohexyl)pyridin-2-amine
CID 62289350
5-(2-aminoethyl)-N-cyclopropyl-N,3-dimethylpyridin-2-amine
CID 80633656

Frequently Asked Questions

What is the IUPAC name of 5-(bromomethyl)-N,3-dimethyl-N-(2-methylcyclohexyl)pyridin-2-amine?
The IUPAC name of 5-(bromomethyl)-N,3-dimethyl-N-(2-methylcyclohexyl)pyridin-2-amine (CID 107082051) is 5-(bromomethyl)-N,3-dimethyl-N-(2-methylcyclohexyl)pyridin-2-amine.
What is the SMILES notation for 5-(bromomethyl)-N,3-dimethyl-N-(2-methylcyclohexyl)pyridin-2-amine?
The canonical SMILES for 5-(bromomethyl)-N,3-dimethyl-N-(2-methylcyclohexyl)pyridin-2-amine is Cc1cc(CBr)cnc1N(C)C1CCCCC1C.
What is the InChIKey of 5-(bromomethyl)-N,3-dimethyl-N-(2-methylcyclohexyl)pyridin-2-amine?
The InChIKey is OYJIAQWBMDBJFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23BrN2/c1-11-6-4-5-7-14(11)18(3)15-12(2)8-13(9-16)10-17-15/h8,10-11,14H,4-7,9H2,1-3H3.
What are the key properties of 5-(bromomethyl)-N,3-dimethyl-N-(2-methylcyclohexyl)pyridin-2-amine?
5-(bromomethyl)-N,3-dimethyl-N-(2-methylcyclohexyl)pyridin-2-amine has a molecular weight of 311.27 g/mol, XLogP of 4.30, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(bromomethyl)-N,3-dimethyl-N-(2-methylcyclohexyl)pyridin-2-amine is sourced from PubChem (CID 107082051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).