N-[(1-methylcyclopentyl)methyl]thieno[3,2-c]pyridin-4-amine

C14H18N2S — CID 55261967

IUPACN-[(1-methylcyclopentyl)methyl]thieno[3,2-c]pyridin-4-amine
SMILESCC1(CNc2nccc3sccc23)CCCC1
InChIInChI=1S/C14H18N2S/c1-14(6-2-3-7-14)10-16-13-11-5-9-17-12(11)4-8-15-13/h4-5,8-9H,2-3,6-7,10H2,1H3,(H,15,16)
InChIKeyFKXBWRMPJNRZJW-UHFFFAOYSA-N
MW246.38 g/mol
LogP4.29
Rot. Bonds3

About N-[(1-methylcyclopentyl)methyl]thieno[3,2-c]pyridin-4-amine

N-[(1-methylcyclopentyl)methyl]thieno[3,2-c]pyridin-4-amine (PubChem CID 55261967) has the molecular formula C14H18N2S and a molecular weight of 246.38 g/mol. Its IUPAC name is N-[(1-methylcyclopentyl)methyl]thieno[3,2-c]pyridin-4-amine.

Molecular Properties

Compound NameN-[(1-methylcyclopentyl)methyl]thieno[3,2-c]pyridin-4-amine
PubChem CID55261967
Molecular FormulaC14H18N2S
Molecular Weight246.38 g/mol
Exact Mass246.12
IUPAC NameN-[(1-methylcyclopentyl)methyl]thieno[3,2-c]pyridin-4-amine
SMILESCC1(CNc2nccc3sccc23)CCCC1
InChIInChI=1S/C14H18N2S/c1-14(6-2-3-7-14)10-16-13-11-5-9-17-12(11)4-8-15-13/h4-5,8-9H,2-3,6-7,10H2,1H3,(H,15,16)
InChIKeyFKXBWRMPJNRZJW-UHFFFAOYSA-N
XLogP4.29
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.38
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(1-methylcyclopentyl)methyl]thieno[3,2-c]pyridin-4-amine?
The IUPAC name of N-[(1-methylcyclopentyl)methyl]thieno[3,2-c]pyridin-4-amine (CID 55261967) is N-[(1-methylcyclopentyl)methyl]thieno[3,2-c]pyridin-4-amine.
What is the SMILES notation for N-[(1-methylcyclopentyl)methyl]thieno[3,2-c]pyridin-4-amine?
The canonical SMILES for N-[(1-methylcyclopentyl)methyl]thieno[3,2-c]pyridin-4-amine is CC1(CNc2nccc3sccc23)CCCC1.
What is the InChIKey of N-[(1-methylcyclopentyl)methyl]thieno[3,2-c]pyridin-4-amine?
The InChIKey is FKXBWRMPJNRZJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2S/c1-14(6-2-3-7-14)10-16-13-11-5-9-17-12(11)4-8-15-13/h4-5,8-9H,2-3,6-7,10H2,1H3,(H,15,16).
What are the key properties of N-[(1-methylcyclopentyl)methyl]thieno[3,2-c]pyridin-4-amine?
N-[(1-methylcyclopentyl)methyl]thieno[3,2-c]pyridin-4-amine has a molecular weight of 246.38 g/mol, XLogP of 4.29, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylcyclopentyl)methyl]thieno[3,2-c]pyridin-4-amine is sourced from PubChem (CID 55261967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).