[2-[(5-chlorothiophen-2-yl)methoxy]naphthalen-1-yl]methanamine

C16H14ClNOS — CID 60887305

IUPAC[2-[(5-chlorothiophen-2-yl)methoxy]naphthalen-1-yl]methanamine
SMILESNCc1c(OCc2ccc(Cl)s2)ccc2ccccc12
InChIInChI=1S/C16H14ClNOS/c17-16-8-6-12(20-16)10-19-15-7-5-11-3-1-2-4-13(11)14(15)9-18/h1-8H,9-10,18H2
InChIKeyFBNSDSSOQSRIAA-UHFFFAOYSA-N
MW303.81 g/mol
LogP4.59
Rot. Bonds4

About [2-[(5-chlorothiophen-2-yl)methoxy]naphthalen-1-yl]methanamine

[2-[(5-chlorothiophen-2-yl)methoxy]naphthalen-1-yl]methanamine (PubChem CID 60887305) has the molecular formula C16H14ClNOS and a molecular weight of 303.81 g/mol. Its IUPAC name is [2-[(5-chlorothiophen-2-yl)methoxy]naphthalen-1-yl]methanamine.

Molecular Properties

Compound Name[2-[(5-chlorothiophen-2-yl)methoxy]naphthalen-1-yl]methanamine
PubChem CID60887305
Molecular FormulaC16H14ClNOS
Molecular Weight303.81 g/mol
Exact Mass303.05
IUPAC Name[2-[(5-chlorothiophen-2-yl)methoxy]naphthalen-1-yl]methanamine
SMILESNCc1c(OCc2ccc(Cl)s2)ccc2ccccc12
InChIInChI=1S/C16H14ClNOS/c17-16-8-6-12(20-16)10-19-15-7-5-11-3-1-2-4-13(11)14(15)9-18/h1-8H,9-10,18H2
InChIKeyFBNSDSSOQSRIAA-UHFFFAOYSA-N
XLogP4.59
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.81
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [2-[(5-chlorothiophen-2-yl)methoxy]naphthalen-1-yl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[2-[(5-chlorothiophen-2-yl)methoxy]naphthalen-1-yl]methanol
CID 43505734
4-[(5-chlorothiophen-2-yl)methoxy]naphthalen-1-amine
CID 63691859
2-chloro-5-(phenoxymethyl)thiophene
CID 60655556
[2-[(3-fluorophenyl)methoxy]naphthalen-1-yl]methanamine
CID 43505452
[2-(oxan-4-ylmethoxy)naphthalen-1-yl]methanamine
CID 62386750
[2-(ethoxymethoxy)naphthalen-1-yl]methanamine
CID 65369670
2-(2-phenylmethoxynaphthalen-1-yl)ethanamine
CID 60905443
[2-[(5-chlorothiophen-2-yl)methoxy]-5-methoxyphenyl]methanamine
CID 60878324
1-[1-(aminomethyl)naphthalen-2-yl]oxypropan-2-ol
CID 60888861
3-[(5-chlorothiophen-2-yl)methoxy]pyridin-2-amine
CID 43125741
[2-(2-naphthalen-2-yloxyethoxy)naphthalen-1-yl]methanamine
CID 20985427
[2-[(1-methyltriazol-4-yl)methoxy]naphthalen-1-yl]methanamine
CID 107041260

Frequently Asked Questions

What is the IUPAC name of [2-[(5-chlorothiophen-2-yl)methoxy]naphthalen-1-yl]methanamine?
The IUPAC name of [2-[(5-chlorothiophen-2-yl)methoxy]naphthalen-1-yl]methanamine (CID 60887305) is [2-[(5-chlorothiophen-2-yl)methoxy]naphthalen-1-yl]methanamine.
What is the SMILES notation for [2-[(5-chlorothiophen-2-yl)methoxy]naphthalen-1-yl]methanamine?
The canonical SMILES for [2-[(5-chlorothiophen-2-yl)methoxy]naphthalen-1-yl]methanamine is NCc1c(OCc2ccc(Cl)s2)ccc2ccccc12.
What is the InChIKey of [2-[(5-chlorothiophen-2-yl)methoxy]naphthalen-1-yl]methanamine?
The InChIKey is FBNSDSSOQSRIAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14ClNOS/c17-16-8-6-12(20-16)10-19-15-7-5-11-3-1-2-4-13(11)14(15)9-18/h1-8H,9-10,18H2.
What are the key properties of [2-[(5-chlorothiophen-2-yl)methoxy]naphthalen-1-yl]methanamine?
[2-[(5-chlorothiophen-2-yl)methoxy]naphthalen-1-yl]methanamine has a molecular weight of 303.81 g/mol, XLogP of 4.59, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(5-chlorothiophen-2-yl)methoxy]naphthalen-1-yl]methanamine is sourced from PubChem (CID 60887305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).