N-(furan-2-ylmethyl)-1-(4-phenylmethoxyphenyl)methanamine;hydrochloride

C19H20ClNO2 — CID 2995197

IUPACN-(furan-2-ylmethyl)-1-(4-phenylmethoxyphenyl)methanamine;hydrochloride
SMILESCl.c1ccc(COc2ccc(CNCc3ccco3)cc2)cc1
InChIInChI=1S/C19H19NO2.ClH/c1-2-5-17(6-3-1)15-22-18-10-8-16(9-11-18)13-20-14-19-7-4-12-21-19;/h1-12,20H,13-15H2;1H
InChIKeyPQLAFRTYGMIPHQ-UHFFFAOYSA-N
MW329.83 g/mol
LogP4.57
Rot. Bonds7

About N-(furan-2-ylmethyl)-1-(4-phenylmethoxyphenyl)methanamine;hydrochloride

N-(furan-2-ylmethyl)-1-(4-phenylmethoxyphenyl)methanamine;hydrochloride (PubChem CID 2995197) has the molecular formula C19H20ClNO2 and a molecular weight of 329.83 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-1-(4-phenylmethoxyphenyl)methanamine;hydrochloride.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-1-(4-phenylmethoxyphenyl)methanamine;hydrochloride
PubChem CID2995197
Molecular FormulaC19H20ClNO2
Molecular Weight329.83 g/mol
Exact Mass329.12
IUPAC NameN-(furan-2-ylmethyl)-1-(4-phenylmethoxyphenyl)methanamine;hydrochloride
SMILESCl.c1ccc(COc2ccc(CNCc3ccco3)cc2)cc1
InChIInChI=1S/C19H19NO2.ClH/c1-2-5-17(6-3-1)15-22-18-10-8-16(9-11-18)13-20-14-19-7-4-12-21-19;/h1-12,20H,13-15H2;1H
InChIKeyPQLAFRTYGMIPHQ-UHFFFAOYSA-N
XLogP4.57
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.83
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-[(4-chlorophenyl)methoxy]phenyl]-N-(furan-2-ylmethyl)methanamine
CID 2993502
N-(furan-2-ylmethyl)-1-(3-phenylmethoxyphenyl)methanamine;hydrochloride
CID 2996544
N-(furan-2-ylmethyl)-1-[3-[(4-methylphenyl)methoxy]phenyl]methanamine
CID 17055149
1-(4-phenylmethoxyphenyl)-N-(pyridin-2-ylmethyl)methanamine;hydrochloride
CID 17294585
1-[2-[(4-chlorophenyl)methoxy]phenyl]-N-(furan-2-ylmethyl)methanamine;hydrochloride
CID 17331629
N-benzyl-2-(furan-2-ylmethoxy)ethanamine
CID 62564992
N-(1,3-benzodioxol-5-ylmethyl)-1-(4-phenylmethoxyphenyl)methanamine;hydrochloride
CID 17291782
2-[(4-phenylmethoxyphenyl)methylamino]ethanol
CID 2200287
1-(furan-2-yl)-N-phenylmethoxymethanamine
CID 82709159
1-(benzylperoxymethyl)-4-[[4-[(4-phenylmethoxyphenyl)methoxy]phenyl]methoxy]benzene
CID 156694250
N-(furan-2-ylmethyl)-1-[3-(methoxymethyl)phenyl]methanamine
CID 54893676
1-[4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]-N-(furan-2-ylmethyl)methanamine;hydrochloride
CID 17331634

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-1-(4-phenylmethoxyphenyl)methanamine;hydrochloride?
The IUPAC name of N-(furan-2-ylmethyl)-1-(4-phenylmethoxyphenyl)methanamine;hydrochloride (CID 2995197) is N-(furan-2-ylmethyl)-1-(4-phenylmethoxyphenyl)methanamine;hydrochloride.
What is the SMILES notation for N-(furan-2-ylmethyl)-1-(4-phenylmethoxyphenyl)methanamine;hydrochloride?
The canonical SMILES for N-(furan-2-ylmethyl)-1-(4-phenylmethoxyphenyl)methanamine;hydrochloride is Cl.c1ccc(COc2ccc(CNCc3ccco3)cc2)cc1.
What is the InChIKey of N-(furan-2-ylmethyl)-1-(4-phenylmethoxyphenyl)methanamine;hydrochloride?
The InChIKey is PQLAFRTYGMIPHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO2.ClH/c1-2-5-17(6-3-1)15-22-18-10-8-16(9-11-18)13-20-14-19-7-4-12-21-19;/h1-12,20H,13-15H2;1H.
What are the key properties of N-(furan-2-ylmethyl)-1-(4-phenylmethoxyphenyl)methanamine;hydrochloride?
N-(furan-2-ylmethyl)-1-(4-phenylmethoxyphenyl)methanamine;hydrochloride has a molecular weight of 329.83 g/mol, XLogP of 4.57, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-1-(4-phenylmethoxyphenyl)methanamine;hydrochloride is sourced from PubChem (CID 2995197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).