1-[4-(methoxymethyl)phenyl]-N-(pyridin-2-ylmethyl)methanamine

C15H18N2O — CID 60751892

IUPAC1-[4-(methoxymethyl)phenyl]-N-(pyridin-2-ylmethyl)methanamine
SMILESCOCc1ccc(CNCc2ccccn2)cc1
InChIInChI=1S/C15H18N2O/c1-18-12-14-7-5-13(6-8-14)10-16-11-15-4-2-3-9-17-15/h2-9,16H,10-12H2,1H3
InChIKeyNGLMROYLWXNZDW-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.52
Rot. Bonds6

About 1-[4-(methoxymethyl)phenyl]-N-(pyridin-2-ylmethyl)methanamine

1-[4-(methoxymethyl)phenyl]-N-(pyridin-2-ylmethyl)methanamine (PubChem CID 60751892) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 1-[4-(methoxymethyl)phenyl]-N-(pyridin-2-ylmethyl)methanamine.

Molecular Properties

Compound Name1-[4-(methoxymethyl)phenyl]-N-(pyridin-2-ylmethyl)methanamine
PubChem CID60751892
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name1-[4-(methoxymethyl)phenyl]-N-(pyridin-2-ylmethyl)methanamine
SMILESCOCc1ccc(CNCc2ccccn2)cc1
InChIInChI=1S/C15H18N2O/c1-18-12-14-7-5-13(6-8-14)10-16-11-15-4-2-3-9-17-15/h2-9,16H,10-12H2,1H3
InChIKeyNGLMROYLWXNZDW-UHFFFAOYSA-N
XLogP2.52
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-methylphenyl)-N-(pyridin-2-ylmethyl)methanamine;hydrochloride
CID 44782427
1-(4-phenylmethoxyphenyl)-N-(pyridin-2-ylmethyl)methanamine;hydrochloride
CID 17294585
azane;methane;[4-[(pyridin-2-ylmethylamino)methyl]phenyl]methanamine
CID 158212763
N,N-diethyl-4-[(pyridin-2-ylmethylamino)methyl]aniline
CID 834543
zinc;1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;dihydrochloride
CID 73345757
N-benzyl-N'-(pyridin-2-ylmethyl)ethane-1,2-diamine
CID 90740224
1-[4-[(4-fluorophenyl)methoxy]-3-methoxyphenyl]-N-(pyridin-2-ylmethyl)methanamine
CID 4720336
1-(3-bromo-4-methoxyphenyl)-N-(pyridin-2-ylmethyl)methanamine
CID 29223796
1-[4-(methoxymethyl)phenyl]-N-(1,3-oxazol-4-ylmethyl)methanamine
CID 119138512
2-[4-[(pyridin-2-ylmethylamino)methyl]phenyl]acetic acid
CID 103235916
1-(3-ethoxy-4-phenylmethoxyphenyl)-N-(pyridin-2-ylmethyl)methanamine;hydrochloride
CID 6459415
1-[4-[(2-chlorophenyl)methoxy]phenyl]-N-(pyridin-2-ylmethyl)methanamine;hydrochloride
CID 6461106

Frequently Asked Questions

What is the IUPAC name of 1-[4-(methoxymethyl)phenyl]-N-(pyridin-2-ylmethyl)methanamine?
The IUPAC name of 1-[4-(methoxymethyl)phenyl]-N-(pyridin-2-ylmethyl)methanamine (CID 60751892) is 1-[4-(methoxymethyl)phenyl]-N-(pyridin-2-ylmethyl)methanamine.
What is the SMILES notation for 1-[4-(methoxymethyl)phenyl]-N-(pyridin-2-ylmethyl)methanamine?
The canonical SMILES for 1-[4-(methoxymethyl)phenyl]-N-(pyridin-2-ylmethyl)methanamine is COCc1ccc(CNCc2ccccn2)cc1.
What is the InChIKey of 1-[4-(methoxymethyl)phenyl]-N-(pyridin-2-ylmethyl)methanamine?
The InChIKey is NGLMROYLWXNZDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-18-12-14-7-5-13(6-8-14)10-16-11-15-4-2-3-9-17-15/h2-9,16H,10-12H2,1H3.
What are the key properties of 1-[4-(methoxymethyl)phenyl]-N-(pyridin-2-ylmethyl)methanamine?
1-[4-(methoxymethyl)phenyl]-N-(pyridin-2-ylmethyl)methanamine has a molecular weight of 242.32 g/mol, XLogP of 2.52, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(methoxymethyl)phenyl]-N-(pyridin-2-ylmethyl)methanamine is sourced from PubChem (CID 60751892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).