[4-[(4-chlorophenyl)methyl-methylamino]-2-pyridinyl]methanol

C14H15ClN2O — CID 61415178

IUPAC[4-[(4-chlorophenyl)methyl-methylamino]-2-pyridinyl]methanol
SMILESCN(Cc1ccc(Cl)cc1)c1ccnc(CO)c1
InChIInChI=1S/C14H15ClN2O/c1-17(9-11-2-4-12(15)5-3-11)14-6-7-16-13(8-14)10-18/h2-8,18H,9-10H2,1H3
InChIKeyLDULNBUNGXPLPV-UHFFFAOYSA-N
MW262.74 g/mol
LogP2.86
Rot. Bonds4

About [4-[(4-chlorophenyl)methyl-methylamino]-2-pyridinyl]methanol

[4-[(4-chlorophenyl)methyl-methylamino]-2-pyridinyl]methanol (PubChem CID 61415178) has the molecular formula C14H15ClN2O and a molecular weight of 262.74 g/mol. Its IUPAC name is [4-[(4-chlorophenyl)methyl-methylamino]-2-pyridinyl]methanol.

Molecular Properties

Compound Name[4-[(4-chlorophenyl)methyl-methylamino]-2-pyridinyl]methanol
PubChem CID61415178
Molecular FormulaC14H15ClN2O
Molecular Weight262.74 g/mol
Exact Mass262.09
IUPAC Name[4-[(4-chlorophenyl)methyl-methylamino]-2-pyridinyl]methanol
SMILESCN(Cc1ccc(Cl)cc1)c1ccnc(CO)c1
InChIInChI=1S/C14H15ClN2O/c1-17(9-11-2-4-12(15)5-3-11)14-6-7-16-13(8-14)10-18/h2-8,18H,9-10H2,1H3
InChIKeyLDULNBUNGXPLPV-UHFFFAOYSA-N
XLogP2.86
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.74
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-[methyl(pyridin-4-ylmethyl)amino]-2-pyridinyl]methanol
CID 61255837
2-chloro-N-[(4-chlorophenyl)methyl]-N-methylpyridin-4-amine
CID 102824052
4-N-[(4-chlorophenyl)methyl]-2-N,4-N-dimethylpyridine-2,4-diamine
CID 113367580
2-(chloromethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyridin-4-amine
CID 61413503
[4-[(3-fluoro-4-pyridin-3-ylphenyl)methyl-methylamino]-2-pyridinyl]methanol
CID 167799537
[4-[3-(dimethylamino)propyl-methylamino]-2-pyridinyl]methanol
CID 63700089
N-[(4-bromophenyl)methyl]-2-(ethylaminomethyl)-N-methylpyridin-4-amine
CID 62287139
2-chloro-N-(furan-3-ylmethyl)-N-methylpyridin-4-amine
CID 103756524
N-methyl-N-[(4-methylphenyl)methyl]-2-[(propan-2-ylamino)methyl]pyridin-4-amine
CID 62280879
[4-[benzyl(propan-2-yl)amino]-2-pyridinyl]methanol
CID 61254549
N-[(4-bromophenyl)methyl]-N-methyl-2-[(propan-2-ylamino)methyl]pyridin-4-amine
CID 62287320
[4-chloro-2-[(4-chlorophenyl)methyl-methylamino]phenyl]methanol
CID 114845317

Frequently Asked Questions

What is the IUPAC name of [4-[(4-chlorophenyl)methyl-methylamino]-2-pyridinyl]methanol?
The IUPAC name of [4-[(4-chlorophenyl)methyl-methylamino]-2-pyridinyl]methanol (CID 61415178) is [4-[(4-chlorophenyl)methyl-methylamino]-2-pyridinyl]methanol.
What is the SMILES notation for [4-[(4-chlorophenyl)methyl-methylamino]-2-pyridinyl]methanol?
The canonical SMILES for [4-[(4-chlorophenyl)methyl-methylamino]-2-pyridinyl]methanol is CN(Cc1ccc(Cl)cc1)c1ccnc(CO)c1.
What is the InChIKey of [4-[(4-chlorophenyl)methyl-methylamino]-2-pyridinyl]methanol?
The InChIKey is LDULNBUNGXPLPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O/c1-17(9-11-2-4-12(15)5-3-11)14-6-7-16-13(8-14)10-18/h2-8,18H,9-10H2,1H3.
What are the key properties of [4-[(4-chlorophenyl)methyl-methylamino]-2-pyridinyl]methanol?
[4-[(4-chlorophenyl)methyl-methylamino]-2-pyridinyl]methanol has a molecular weight of 262.74 g/mol, XLogP of 2.86, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(4-chlorophenyl)methyl-methylamino]-2-pyridinyl]methanol is sourced from PubChem (CID 61415178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).