(3-chlorothiophen-2-yl)-(1-piperidin-1-ylcyclopentyl)methanamine

C15H23ClN2S — CID 107359921

IUPAC(3-chlorothiophen-2-yl)-(1-piperidin-1-ylcyclopentyl)methanamine
SMILESNC(c1sccc1Cl)C1(N2CCCCC2)CCCC1
InChIInChI=1S/C15H23ClN2S/c16-12-6-11-19-13(12)14(17)15(7-2-3-8-15)18-9-4-1-5-10-18/h6,11,14H,1-5,7-10,17H2
InChIKeyMGLQILIMKFJOJZ-UHFFFAOYSA-N
MW298.88 g/mol
LogP4.20
Rot. Bonds3

About (3-chlorothiophen-2-yl)-(1-piperidin-1-ylcyclopentyl)methanamine

(3-chlorothiophen-2-yl)-(1-piperidin-1-ylcyclopentyl)methanamine (PubChem CID 107359921) has the molecular formula C15H23ClN2S and a molecular weight of 298.88 g/mol. Its IUPAC name is (3-chlorothiophen-2-yl)-(1-piperidin-1-ylcyclopentyl)methanamine.

Molecular Properties

Compound Name(3-chlorothiophen-2-yl)-(1-piperidin-1-ylcyclopentyl)methanamine
PubChem CID107359921
Molecular FormulaC15H23ClN2S
Molecular Weight298.88 g/mol
Exact Mass298.13
IUPAC Name(3-chlorothiophen-2-yl)-(1-piperidin-1-ylcyclopentyl)methanamine
SMILESNC(c1sccc1Cl)C1(N2CCCCC2)CCCC1
InChIInChI=1S/C15H23ClN2S/c16-12-6-11-19-13(12)14(17)15(7-2-3-8-15)18-9-4-1-5-10-18/h6,11,14H,1-5,7-10,17H2
InChIKeyMGLQILIMKFJOJZ-UHFFFAOYSA-N
XLogP4.20
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.88
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3-chlorothiophen-2-yl)-(1-methoxycyclohexyl)methanamine
CID 107360272
(2,5-dichlorophenyl)-(1-pyrrolidin-1-ylcyclopentyl)methanamine
CID 79058950
[(3-bromothiophen-2-yl)-(1-piperidin-1-ylcyclopentyl)methyl]hydrazine
CID 105243027
(3-chlorophenyl)-(1-pyrrolidin-1-ylcyclopentyl)methanamine
CID 79058711
N-methyl-1-(3-methylthiophen-2-yl)-1-(1-pyrrolidin-1-ylcyclopentyl)methanamine
CID 79988934
1-(1-piperidin-1-ylcyclopentyl)-3-thiophen-2-ylpropan-1-amine
CID 79059762
[(2-methylthiophen-3-yl)-(1-piperidin-1-ylcyclopentyl)methyl]hydrazine
CID 102842888
(4-bromo-3-chloro-2-fluorophenyl)-(1-pyrrolidin-1-ylcyclopentyl)methanamine
CID 106762721
cyclohexen-1-yl-(1-piperidin-1-ylcyclopentyl)methanamine
CID 106653694
phenyl-(1-pyrrolidin-1-ylcyclopropyl)methanamine
CID 59197912
1-[amino-(3-chlorothiophen-2-yl)methyl]-N,N,3-trimethylcyclohexan-1-amine
CID 107359933
1-(1-pyrrolidin-1-ylcyclopentyl)-3-thiophen-2-ylpropan-1-amine
CID 79057434

Frequently Asked Questions

What is the IUPAC name of (3-chlorothiophen-2-yl)-(1-piperidin-1-ylcyclopentyl)methanamine?
The IUPAC name of (3-chlorothiophen-2-yl)-(1-piperidin-1-ylcyclopentyl)methanamine (CID 107359921) is (3-chlorothiophen-2-yl)-(1-piperidin-1-ylcyclopentyl)methanamine.
What is the SMILES notation for (3-chlorothiophen-2-yl)-(1-piperidin-1-ylcyclopentyl)methanamine?
The canonical SMILES for (3-chlorothiophen-2-yl)-(1-piperidin-1-ylcyclopentyl)methanamine is NC(c1sccc1Cl)C1(N2CCCCC2)CCCC1.
What is the InChIKey of (3-chlorothiophen-2-yl)-(1-piperidin-1-ylcyclopentyl)methanamine?
The InChIKey is MGLQILIMKFJOJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23ClN2S/c16-12-6-11-19-13(12)14(17)15(7-2-3-8-15)18-9-4-1-5-10-18/h6,11,14H,1-5,7-10,17H2.
What are the key properties of (3-chlorothiophen-2-yl)-(1-piperidin-1-ylcyclopentyl)methanamine?
(3-chlorothiophen-2-yl)-(1-piperidin-1-ylcyclopentyl)methanamine has a molecular weight of 298.88 g/mol, XLogP of 4.20, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chlorothiophen-2-yl)-(1-piperidin-1-ylcyclopentyl)methanamine is sourced from PubChem (CID 107359921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).