1-(1-methoxycyclobutyl)-N-methyl-1-thiophen-2-ylmethanamine

C11H17NOS — CID 116714360

IUPAC1-(1-methoxycyclobutyl)-N-methyl-1-thiophen-2-ylmethanamine
SMILESCNC(c1cccs1)C1(OC)CCC1
InChIInChI=1S/C11H17NOS/c1-12-10(9-5-3-8-14-9)11(13-2)6-4-7-11/h3,5,8,10,12H,4,6-7H2,1-2H3
InChIKeySHWYNEIPLBNUQP-UHFFFAOYSA-N
MW211.33 g/mol
LogP2.58
Rot. Bonds4

About 1-(1-methoxycyclobutyl)-N-methyl-1-thiophen-2-ylmethanamine

1-(1-methoxycyclobutyl)-N-methyl-1-thiophen-2-ylmethanamine (PubChem CID 116714360) has the molecular formula C11H17NOS and a molecular weight of 211.33 g/mol. Its IUPAC name is 1-(1-methoxycyclobutyl)-N-methyl-1-thiophen-2-ylmethanamine.

Molecular Properties

Compound Name1-(1-methoxycyclobutyl)-N-methyl-1-thiophen-2-ylmethanamine
PubChem CID116714360
Molecular FormulaC11H17NOS
Molecular Weight211.33 g/mol
Exact Mass211.10
IUPAC Name1-(1-methoxycyclobutyl)-N-methyl-1-thiophen-2-ylmethanamine
SMILESCNC(c1cccs1)C1(OC)CCC1
InChIInChI=1S/C11H17NOS/c1-12-10(9-5-3-8-14-9)11(13-2)6-4-7-11/h3,5,8,10,12H,4,6-7H2,1-2H3
InChIKeySHWYNEIPLBNUQP-UHFFFAOYSA-N
XLogP2.58
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-ethoxy-4,4-dimethylcyclohexyl)-N-methyl-1-thiophen-2-ylmethanamine
CID 116768795
1-(2,6-difluorophenyl)-1-(1-methoxycyclopentyl)-N-methylmethanamine
CID 104611051
1-(3-bromothiophen-2-yl)-1-(1-methoxycyclohexyl)-N-methylmethanamine
CID 116762885
1-(1-benzothiophen-7-yl)-1-(1-methoxycyclohexyl)-N-methylmethanamine
CID 116762819
1-(1-adamantyl)-N-methyl-1-thiophen-2-ylmethanamine
CID 43483460
1-(2,6-difluorophenyl)-1-(1-methoxycycloheptyl)-N-methylmethanamine
CID 116770190
1-(1-methoxycycloheptyl)-2-thiophen-2-ylethanol
CID 116755920
1-(1-methoxycyclohexyl)-2-thiophen-2-ylethanol
CID 116753410
1-(1-methoxycyclohexyl)-N-methyl-1-(4-propan-2-ylphenyl)methanamine
CID 116762847
N-methyl-1-(1-morpholin-4-ylcyclopentyl)-1-thiophen-2-ylmethanamine
CID 79066848
1-(1-methoxycyclopentyl)-N-methyl-1-naphthalen-2-ylmethanamine
CID 104611046
(1-methoxy-4,4-dimethylcyclohexyl)-thiophen-2-ylmethanol
CID 116755748

Frequently Asked Questions

What is the IUPAC name of 1-(1-methoxycyclobutyl)-N-methyl-1-thiophen-2-ylmethanamine?
The IUPAC name of 1-(1-methoxycyclobutyl)-N-methyl-1-thiophen-2-ylmethanamine (CID 116714360) is 1-(1-methoxycyclobutyl)-N-methyl-1-thiophen-2-ylmethanamine.
What is the SMILES notation for 1-(1-methoxycyclobutyl)-N-methyl-1-thiophen-2-ylmethanamine?
The canonical SMILES for 1-(1-methoxycyclobutyl)-N-methyl-1-thiophen-2-ylmethanamine is CNC(c1cccs1)C1(OC)CCC1.
What is the InChIKey of 1-(1-methoxycyclobutyl)-N-methyl-1-thiophen-2-ylmethanamine?
The InChIKey is SHWYNEIPLBNUQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NOS/c1-12-10(9-5-3-8-14-9)11(13-2)6-4-7-11/h3,5,8,10,12H,4,6-7H2,1-2H3.
What are the key properties of 1-(1-methoxycyclobutyl)-N-methyl-1-thiophen-2-ylmethanamine?
1-(1-methoxycyclobutyl)-N-methyl-1-thiophen-2-ylmethanamine has a molecular weight of 211.33 g/mol, XLogP of 2.58, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methoxycyclobutyl)-N-methyl-1-thiophen-2-ylmethanamine is sourced from PubChem (CID 116714360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).