N-[(2-methyloxolan-2-yl)methyl]-1-[3-(pyridin-2-ylmethoxy)phenyl]methanamine

C19H24N2O2 — CID 119160323

IUPACN-[(2-methyloxolan-2-yl)methyl]-1-[3-(pyridin-2-ylmethoxy)phenyl]methanamine
SMILESCC1(CNCc2cccc(OCc3ccccn3)c2)CCCO1
InChIInChI=1S/C19H24N2O2/c1-19(9-5-11-23-19)15-20-13-16-6-4-8-18(12-16)22-14-17-7-2-3-10-21-17/h2-4,6-8,10,12,20H,5,9,11,13-15H2,1H3
InChIKeyOOAUXNLHUISVQL-UHFFFAOYSA-N
MW312.41 g/mol
LogP3.32
Rot. Bonds7

About N-[(2-methyloxolan-2-yl)methyl]-1-[3-(pyridin-2-ylmethoxy)phenyl]methanamine

N-[(2-methyloxolan-2-yl)methyl]-1-[3-(pyridin-2-ylmethoxy)phenyl]methanamine (PubChem CID 119160323) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is N-[(2-methyloxolan-2-yl)methyl]-1-[3-(pyridin-2-ylmethoxy)phenyl]methanamine.

Molecular Properties

Compound NameN-[(2-methyloxolan-2-yl)methyl]-1-[3-(pyridin-2-ylmethoxy)phenyl]methanamine
PubChem CID119160323
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC NameN-[(2-methyloxolan-2-yl)methyl]-1-[3-(pyridin-2-ylmethoxy)phenyl]methanamine
SMILESCC1(CNCc2cccc(OCc3ccccn3)c2)CCCO1
InChIInChI=1S/C19H24N2O2/c1-19(9-5-11-23-19)15-20-13-16-6-4-8-18(12-16)22-14-17-7-2-3-10-21-17/h2-4,6-8,10,12,20H,5,9,11,13-15H2,1H3
InChIKeyOOAUXNLHUISVQL-UHFFFAOYSA-N
XLogP3.32
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(3-propyl-1,2-oxazol-5-yl)methyl]-1-[3-(pyridin-2-ylmethoxy)phenyl]methanamine
CID 131927940
1-[(2R)-4-methylmorpholin-2-yl]-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]methanamine
CID 95302096
N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]methanesulfonamide
CID 47064950
2-[[3-(chloromethyl)phenoxy]methyl]pyridine
CID 28534890
2-(4-methoxyphenyl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]-2-pyrrolidin-1-ylethanamine
CID 47030410
1,2-dimethyl-3-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]guanidine
CID 110893221
5-(methoxymethyl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]furan-2-carboxamide
CID 78875904
4-cyclobutyl-4-hydroxy-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]piperidine-1-carboxamide
CID 166255192
4-[[[3,5-dimethyl-4-(pyridin-2-ylmethoxy)phenyl]methylamino]methyl]oxan-4-ol
CID 119115046
(1R)-1-(3-methoxyphenyl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]ethanamine
CID 59803177
1-(3-ethoxyphenyl)-N-[(1-methylcyclopropyl)methyl]methanamine
CID 103724266
(1R)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]-1-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)ethanamine
CID 95282173

Frequently Asked Questions

What is the IUPAC name of N-[(2-methyloxolan-2-yl)methyl]-1-[3-(pyridin-2-ylmethoxy)phenyl]methanamine?
The IUPAC name of N-[(2-methyloxolan-2-yl)methyl]-1-[3-(pyridin-2-ylmethoxy)phenyl]methanamine (CID 119160323) is N-[(2-methyloxolan-2-yl)methyl]-1-[3-(pyridin-2-ylmethoxy)phenyl]methanamine.
What is the SMILES notation for N-[(2-methyloxolan-2-yl)methyl]-1-[3-(pyridin-2-ylmethoxy)phenyl]methanamine?
The canonical SMILES for N-[(2-methyloxolan-2-yl)methyl]-1-[3-(pyridin-2-ylmethoxy)phenyl]methanamine is CC1(CNCc2cccc(OCc3ccccn3)c2)CCCO1.
What is the InChIKey of N-[(2-methyloxolan-2-yl)methyl]-1-[3-(pyridin-2-ylmethoxy)phenyl]methanamine?
The InChIKey is OOAUXNLHUISVQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-19(9-5-11-23-19)15-20-13-16-6-4-8-18(12-16)22-14-17-7-2-3-10-21-17/h2-4,6-8,10,12,20H,5,9,11,13-15H2,1H3.
What are the key properties of N-[(2-methyloxolan-2-yl)methyl]-1-[3-(pyridin-2-ylmethoxy)phenyl]methanamine?
N-[(2-methyloxolan-2-yl)methyl]-1-[3-(pyridin-2-ylmethoxy)phenyl]methanamine has a molecular weight of 312.41 g/mol, XLogP of 3.32, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methyloxolan-2-yl)methyl]-1-[3-(pyridin-2-ylmethoxy)phenyl]methanamine is sourced from PubChem (CID 119160323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).