N-[[2-(aminomethyl)furan-3-yl]methyl]-2-methoxy-N-methylaniline

C14H18N2O2 — CID 62428788

IUPACN-[[2-(aminomethyl)furan-3-yl]methyl]-2-methoxy-N-methylaniline
SMILESCOc1ccccc1N(C)Cc1ccoc1CN
InChIInChI=1S/C14H18N2O2/c1-16(10-11-7-8-18-14(11)9-15)12-5-3-4-6-13(12)17-2/h3-8H,9-10,15H2,1-2H3
InChIKeyDAKWTLSCLZTTFX-UHFFFAOYSA-N
MW246.31 g/mol
LogP2.38
Rot. Bonds5

About N-[[2-(aminomethyl)furan-3-yl]methyl]-2-methoxy-N-methylaniline

N-[[2-(aminomethyl)furan-3-yl]methyl]-2-methoxy-N-methylaniline (PubChem CID 62428788) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is N-[[2-(aminomethyl)furan-3-yl]methyl]-2-methoxy-N-methylaniline.

Molecular Properties

Compound NameN-[[2-(aminomethyl)furan-3-yl]methyl]-2-methoxy-N-methylaniline
PubChem CID62428788
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC NameN-[[2-(aminomethyl)furan-3-yl]methyl]-2-methoxy-N-methylaniline
SMILESCOc1ccccc1N(C)Cc1ccoc1CN
InChIInChI=1S/C14H18N2O2/c1-16(10-11-7-8-18-14(11)9-15)12-5-3-4-6-13(12)17-2/h3-8H,9-10,15H2,1-2H3
InChIKeyDAKWTLSCLZTTFX-UHFFFAOYSA-N
XLogP2.38
TPSA51.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[2-[(cyclopropylamino)methyl]furan-3-yl]methyl]-2-methoxy-N-methylaniline
CID 62428787
N-[[3-(aminomethyl)-2-fluorophenyl]methyl]-2-methoxy-N-methylaniline
CID 107113327
N-[[5-(aminomethyl)-2-methoxyphenyl]methyl]-2-methoxy-N-methylaniline
CID 62018180
5-methoxy-2-[(2-methoxy-N-methylanilino)methyl]aniline
CID 115414026
[3-[[(4-methoxyphenyl)methyl-methylamino]methyl]furan-2-yl]methanamine
CID 62436265
N-[[2-(aminomethyl)furan-3-yl]methyl]-N-ethyl-2-fluoroaniline
CID 62428968
N'-[[2-(aminomethyl)furan-3-yl]methyl]-N,N,N'-trimethylethane-1,2-diamine
CID 63725121
[3-(2,6-dimethoxyphenyl)furan-2-yl]methanamine
CID 106888051
4-chloro-2-[(2-methoxy-N-methylanilino)methyl]phenol
CID 82978276
N-(hydrazinylmethyl)-2-methoxy-N-methylaniline
CID 115260697
N-[(4-hydrazinyl-2-pyridinyl)methyl]-2-methoxy-N-methylaniline
CID 79260460
5-[(2-methoxy-N-methylanilino)methyl]-1,3-thiazol-2-amine
CID 79772599

Frequently Asked Questions

What is the IUPAC name of N-[[2-(aminomethyl)furan-3-yl]methyl]-2-methoxy-N-methylaniline?
The IUPAC name of N-[[2-(aminomethyl)furan-3-yl]methyl]-2-methoxy-N-methylaniline (CID 62428788) is N-[[2-(aminomethyl)furan-3-yl]methyl]-2-methoxy-N-methylaniline.
What is the SMILES notation for N-[[2-(aminomethyl)furan-3-yl]methyl]-2-methoxy-N-methylaniline?
The canonical SMILES for N-[[2-(aminomethyl)furan-3-yl]methyl]-2-methoxy-N-methylaniline is COc1ccccc1N(C)Cc1ccoc1CN.
What is the InChIKey of N-[[2-(aminomethyl)furan-3-yl]methyl]-2-methoxy-N-methylaniline?
The InChIKey is DAKWTLSCLZTTFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c1-16(10-11-7-8-18-14(11)9-15)12-5-3-4-6-13(12)17-2/h3-8H,9-10,15H2,1-2H3.
What are the key properties of N-[[2-(aminomethyl)furan-3-yl]methyl]-2-methoxy-N-methylaniline?
N-[[2-(aminomethyl)furan-3-yl]methyl]-2-methoxy-N-methylaniline has a molecular weight of 246.31 g/mol, XLogP of 2.38, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(aminomethyl)furan-3-yl]methyl]-2-methoxy-N-methylaniline is sourced from PubChem (CID 62428788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).