N-[(2-methoxyphenyl)methyl]-4-(morpholin-4-ylmethyl)aniline

C19H24N2O2 — CID 110452175

IUPACN-[(2-methoxyphenyl)methyl]-4-(morpholin-4-ylmethyl)aniline
SMILESCOc1ccccc1CNc1ccc(CN2CCOCC2)cc1
InChIInChI=1S/C19H24N2O2/c1-22-19-5-3-2-4-17(19)14-20-18-8-6-16(7-9-18)15-21-10-12-23-13-11-21/h2-9,20H,10-15H2,1H3
InChIKeyNSAITHXHWMXEQL-UHFFFAOYSA-N
MW312.41 g/mol
LogP3.14
Rot. Bonds6

About N-[(2-methoxyphenyl)methyl]-4-(morpholin-4-ylmethyl)aniline

N-[(2-methoxyphenyl)methyl]-4-(morpholin-4-ylmethyl)aniline (PubChem CID 110452175) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is N-[(2-methoxyphenyl)methyl]-4-(morpholin-4-ylmethyl)aniline.

Molecular Properties

Compound NameN-[(2-methoxyphenyl)methyl]-4-(morpholin-4-ylmethyl)aniline
PubChem CID110452175
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC NameN-[(2-methoxyphenyl)methyl]-4-(morpholin-4-ylmethyl)aniline
SMILESCOc1ccccc1CNc1ccc(CN2CCOCC2)cc1
InChIInChI=1S/C19H24N2O2/c1-22-19-5-3-2-4-17(19)14-20-18-8-6-16(7-9-18)15-21-10-12-23-13-11-21/h2-9,20H,10-15H2,1H3
InChIKeyNSAITHXHWMXEQL-UHFFFAOYSA-N
XLogP3.14
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2-methoxyphenyl)methyl]-4-morpholin-4-ylaniline;hydrochloride
CID 163329675
(2R)-N-(2-methoxyphenyl)-2-[4-(morpholin-4-ylmethyl)anilino]propanamide
CID 25355403
1-[(4-fluorophenyl)methyl]-4-[(2-methoxyphenyl)methyl]piperazine
CID 2874958
N-[(2-methoxyphenyl)methyl]-4-propylaniline
CID 29045646
2-methoxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]benzamide
CID 17437691
N-[(2,5-dimethoxyphenyl)methyl]-1-[4-(morpholin-4-ylmethyl)phenyl]methanamine
CID 78809737
2-[4-[(2-methoxyphenyl)methylamino]phenyl]acetonitrile
CID 43231857
4-(morpholin-4-ylmethyl)-N-(pyridin-4-ylmethyl)aniline
CID 961221
N-[(2-methoxyphenyl)methyl]-5-(2-morpholin-4-ylethylamino)pyridine-2-carboxamide
CID 109185793
(2-methoxyphenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone
CID 24724219
1-benzyl-4-[(2-methoxyphenyl)methyl]-1,4-diazepane
CID 112808306
N-[(2-methylphenyl)methyl]-4-(piperidin-1-ylmethyl)aniline
CID 83960875

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxyphenyl)methyl]-4-(morpholin-4-ylmethyl)aniline?
The IUPAC name of N-[(2-methoxyphenyl)methyl]-4-(morpholin-4-ylmethyl)aniline (CID 110452175) is N-[(2-methoxyphenyl)methyl]-4-(morpholin-4-ylmethyl)aniline.
What is the SMILES notation for N-[(2-methoxyphenyl)methyl]-4-(morpholin-4-ylmethyl)aniline?
The canonical SMILES for N-[(2-methoxyphenyl)methyl]-4-(morpholin-4-ylmethyl)aniline is COc1ccccc1CNc1ccc(CN2CCOCC2)cc1.
What is the InChIKey of N-[(2-methoxyphenyl)methyl]-4-(morpholin-4-ylmethyl)aniline?
The InChIKey is NSAITHXHWMXEQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-22-19-5-3-2-4-17(19)14-20-18-8-6-16(7-9-18)15-21-10-12-23-13-11-21/h2-9,20H,10-15H2,1H3.
What are the key properties of N-[(2-methoxyphenyl)methyl]-4-(morpholin-4-ylmethyl)aniline?
N-[(2-methoxyphenyl)methyl]-4-(morpholin-4-ylmethyl)aniline has a molecular weight of 312.41 g/mol, XLogP of 3.14, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxyphenyl)methyl]-4-(morpholin-4-ylmethyl)aniline is sourced from PubChem (CID 110452175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).