1-[3-[(3-chlorophenyl)methoxymethyl]furan-2-yl]-N-methylmethanamine

C14H16ClNO2 — CID 65125404

IUPAC1-[3-[(3-chlorophenyl)methoxymethyl]furan-2-yl]-N-methylmethanamine
SMILESCNCc1occc1COCc1cccc(Cl)c1
InChIInChI=1S/C14H16ClNO2/c1-16-8-14-12(5-6-18-14)10-17-9-11-3-2-4-13(15)7-11/h2-7,16H,8-10H2,1H3
InChIKeyBGNNFQJHVYRALJ-UHFFFAOYSA-N
MW265.74 g/mol
LogP3.37
Rot. Bonds6

About 1-[3-[(3-chlorophenyl)methoxymethyl]furan-2-yl]-N-methylmethanamine

1-[3-[(3-chlorophenyl)methoxymethyl]furan-2-yl]-N-methylmethanamine (PubChem CID 65125404) has the molecular formula C14H16ClNO2 and a molecular weight of 265.74 g/mol. Its IUPAC name is 1-[3-[(3-chlorophenyl)methoxymethyl]furan-2-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[3-[(3-chlorophenyl)methoxymethyl]furan-2-yl]-N-methylmethanamine
PubChem CID65125404
Molecular FormulaC14H16ClNO2
Molecular Weight265.74 g/mol
Exact Mass265.09
IUPAC Name1-[3-[(3-chlorophenyl)methoxymethyl]furan-2-yl]-N-methylmethanamine
SMILESCNCc1occc1COCc1cccc(Cl)c1
InChIInChI=1S/C14H16ClNO2/c1-16-8-14-12(5-6-18-14)10-17-9-11-3-2-4-13(15)7-11/h2-7,16H,8-10H2,1H3
InChIKeyBGNNFQJHVYRALJ-UHFFFAOYSA-N
XLogP3.37
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.74
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[3-[(3-chlorophenyl)methoxymethyl]furan-2-yl]methyl]-2-methylpropan-2-amine
CID 65125402
1-[3-[(3-bromophenyl)methoxymethyl]furan-2-yl]-N-methylmethanamine
CID 82832319
N-[[2-[(3-chlorophenyl)methoxymethyl]furan-3-yl]methyl]propan-1-amine
CID 65125350
[2-[(3-chlorophenyl)methoxymethyl]furan-3-yl]methanamine
CID 65125204
1-[3-bromo-4-[(3-chlorophenyl)methoxymethyl]phenyl]-N-methylmethanamine
CID 102773716
2-methyl-N-[[3-(phenylmethoxymethyl)furan-2-yl]methyl]propan-2-amine
CID 62444839
N-[[3-[(4-chlorophenyl)methoxymethyl]furan-2-yl]methyl]propan-1-amine
CID 65125363
N-[[3-[(3-methoxyphenyl)methoxymethyl]furan-2-yl]methyl]cyclopropanamine
CID 62440737
N-[[3-[(3-chlorophenyl)methoxymethyl]phenyl]methyl]propan-1-amine
CID 65125794
1-[3-[(3,4-dichlorophenoxy)methyl]furan-2-yl]-N-methylmethanamine
CID 62485941
N-methyl-1-[3-[2-(2-methylpropoxy)ethoxymethyl]furan-2-yl]methanamine
CID 106449861
1-[4-[(3-chlorophenyl)methoxy]-3,5-dimethylphenyl]-N-methylmethanamine
CID 60879302

Frequently Asked Questions

What is the IUPAC name of 1-[3-[(3-chlorophenyl)methoxymethyl]furan-2-yl]-N-methylmethanamine?
The IUPAC name of 1-[3-[(3-chlorophenyl)methoxymethyl]furan-2-yl]-N-methylmethanamine (CID 65125404) is 1-[3-[(3-chlorophenyl)methoxymethyl]furan-2-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[3-[(3-chlorophenyl)methoxymethyl]furan-2-yl]-N-methylmethanamine?
The canonical SMILES for 1-[3-[(3-chlorophenyl)methoxymethyl]furan-2-yl]-N-methylmethanamine is CNCc1occc1COCc1cccc(Cl)c1.
What is the InChIKey of 1-[3-[(3-chlorophenyl)methoxymethyl]furan-2-yl]-N-methylmethanamine?
The InChIKey is BGNNFQJHVYRALJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16ClNO2/c1-16-8-14-12(5-6-18-14)10-17-9-11-3-2-4-13(15)7-11/h2-7,16H,8-10H2,1H3.
What are the key properties of 1-[3-[(3-chlorophenyl)methoxymethyl]furan-2-yl]-N-methylmethanamine?
1-[3-[(3-chlorophenyl)methoxymethyl]furan-2-yl]-N-methylmethanamine has a molecular weight of 265.74 g/mol, XLogP of 3.37, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[(3-chlorophenyl)methoxymethyl]furan-2-yl]-N-methylmethanamine is sourced from PubChem (CID 65125404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).