[6-[(2-bromophenyl)methyl-methylamino]-3-chloro-2-pyridinyl]methanol

C14H14BrClN2O — CID 61416679

IUPAC[6-[(2-bromophenyl)methyl-methylamino]-3-chloro-2-pyridinyl]methanol
SMILESCN(Cc1ccccc1Br)c1ccc(Cl)c(CO)n1
InChIInChI=1S/C14H14BrClN2O/c1-18(8-10-4-2-3-5-11(10)15)14-7-6-12(16)13(9-19)17-14/h2-7,19H,8-9H2,1H3
InChIKeyONXHZRVHJFPJRE-UHFFFAOYSA-N
MW341.64 g/mol
LogP3.63
Rot. Bonds4

About [6-[(2-bromophenyl)methyl-methylamino]-3-chloro-2-pyridinyl]methanol

[6-[(2-bromophenyl)methyl-methylamino]-3-chloro-2-pyridinyl]methanol (PubChem CID 61416679) has the molecular formula C14H14BrClN2O and a molecular weight of 341.64 g/mol. Its IUPAC name is [6-[(2-bromophenyl)methyl-methylamino]-3-chloro-2-pyridinyl]methanol.

Molecular Properties

Compound Name[6-[(2-bromophenyl)methyl-methylamino]-3-chloro-2-pyridinyl]methanol
PubChem CID61416679
Molecular FormulaC14H14BrClN2O
Molecular Weight341.64 g/mol
Exact Mass340.00
IUPAC Name[6-[(2-bromophenyl)methyl-methylamino]-3-chloro-2-pyridinyl]methanol
SMILESCN(Cc1ccccc1Br)c1ccc(Cl)c(CO)n1
InChIInChI=1S/C14H14BrClN2O/c1-18(8-10-4-2-3-5-11(10)15)14-7-6-12(16)13(9-19)17-14/h2-7,19H,8-9H2,1H3
InChIKeyONXHZRVHJFPJRE-UHFFFAOYSA-N
XLogP3.63
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.64
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[3-chloro-6-[methyl(pyridin-4-ylmethyl)amino]-2-pyridinyl]methanol
CID 61255835
6-(aminomethyl)-5-chloro-N-[(2-chlorophenyl)methyl]-N-methylpyridin-2-amine
CID 62286059
6-bromo-N-[(2-bromophenyl)methyl]-N-methylpyridin-2-amine
CID 63962798
5-chloro-6-(ethylaminomethyl)-N-[(2-fluorophenyl)methyl]-N-methylpyridin-2-amine
CID 62292842
4-N-[(2-bromophenyl)methyl]-2-N,4-N-dimethylpyrimidine-2,4-diamine
CID 80794402
6-[[(2-bromophenyl)methyl-methylamino]methyl]-5-chloropyridin-2-amine
CID 62891171
[3-chloro-6-[cyclobutylmethyl(methyl)amino]-2-pyridinyl]methanol
CID 62861534
3-amino-6-[(2-bromophenyl)methyl-methylamino]pyridine-2-carbonitrile
CID 103467785
N-[(2-bromophenyl)methyl]-6-chloro-N-methyl-4-(trifluoromethyl)pyridin-2-amine
CID 102715585
N-[(2-bromophenyl)methyl]-N-methyl-6-(methylaminomethyl)pyridin-2-amine
CID 62292840
6-[(2-bromophenyl)methyl-methylamino]pyridine-3-carboxylic acid
CID 61420530
N-[(2-bromophenyl)methyl]-N-methylhydroxylamine
CID 82613877

Frequently Asked Questions

What is the IUPAC name of [6-[(2-bromophenyl)methyl-methylamino]-3-chloro-2-pyridinyl]methanol?
The IUPAC name of [6-[(2-bromophenyl)methyl-methylamino]-3-chloro-2-pyridinyl]methanol (CID 61416679) is [6-[(2-bromophenyl)methyl-methylamino]-3-chloro-2-pyridinyl]methanol.
What is the SMILES notation for [6-[(2-bromophenyl)methyl-methylamino]-3-chloro-2-pyridinyl]methanol?
The canonical SMILES for [6-[(2-bromophenyl)methyl-methylamino]-3-chloro-2-pyridinyl]methanol is CN(Cc1ccccc1Br)c1ccc(Cl)c(CO)n1.
What is the InChIKey of [6-[(2-bromophenyl)methyl-methylamino]-3-chloro-2-pyridinyl]methanol?
The InChIKey is ONXHZRVHJFPJRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14BrClN2O/c1-18(8-10-4-2-3-5-11(10)15)14-7-6-12(16)13(9-19)17-14/h2-7,19H,8-9H2,1H3.
What are the key properties of [6-[(2-bromophenyl)methyl-methylamino]-3-chloro-2-pyridinyl]methanol?
[6-[(2-bromophenyl)methyl-methylamino]-3-chloro-2-pyridinyl]methanol has a molecular weight of 341.64 g/mol, XLogP of 3.63, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[(2-bromophenyl)methyl-methylamino]-3-chloro-2-pyridinyl]methanol is sourced from PubChem (CID 61416679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).