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

C14H18N2OS — CID 103794661

IUPACN-[[1-(2-methoxyethyl)cyclopropyl]methyl]thieno[3,2-c]pyridin-4-amine
SMILESCOCCC1(CNc2nccc3sccc23)CC1
InChIInChI=1S/C14H18N2OS/c1-17-8-6-14(4-5-14)10-16-13-11-3-9-18-12(11)2-7-15-13/h2-3,7,9H,4-6,8,10H2,1H3,(H,15,16)
InChIKeyGBVIHLHTHRTMMG-UHFFFAOYSA-N
MW262.38 g/mol
LogP3.52
Rot. Bonds6

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

N-[[1-(2-methoxyethyl)cyclopropyl]methyl]thieno[3,2-c]pyridin-4-amine (PubChem CID 103794661) has the molecular formula C14H18N2OS and a molecular weight of 262.38 g/mol. Its IUPAC name is N-[[1-(2-methoxyethyl)cyclopropyl]methyl]thieno[3,2-c]pyridin-4-amine.

Molecular Properties

Compound NameN-[[1-(2-methoxyethyl)cyclopropyl]methyl]thieno[3,2-c]pyridin-4-amine
PubChem CID103794661
Molecular FormulaC14H18N2OS
Molecular Weight262.38 g/mol
Exact Mass262.11
IUPAC NameN-[[1-(2-methoxyethyl)cyclopropyl]methyl]thieno[3,2-c]pyridin-4-amine
SMILESCOCCC1(CNc2nccc3sccc23)CC1
InChIInChI=1S/C14H18N2OS/c1-17-8-6-14(4-5-14)10-16-13-11-3-9-18-12(11)2-7-15-13/h2-3,7,9H,4-6,8,10H2,1H3,(H,15,16)
InChIKeyGBVIHLHTHRTMMG-UHFFFAOYSA-N
XLogP3.52
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.38
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[1-(2-methoxyethyl)cyclopropyl]methyl]thieno[3,2-c]pyridin-4-amine?
The IUPAC name of N-[[1-(2-methoxyethyl)cyclopropyl]methyl]thieno[3,2-c]pyridin-4-amine (CID 103794661) is N-[[1-(2-methoxyethyl)cyclopropyl]methyl]thieno[3,2-c]pyridin-4-amine.
What is the SMILES notation for N-[[1-(2-methoxyethyl)cyclopropyl]methyl]thieno[3,2-c]pyridin-4-amine?
The canonical SMILES for N-[[1-(2-methoxyethyl)cyclopropyl]methyl]thieno[3,2-c]pyridin-4-amine is COCCC1(CNc2nccc3sccc23)CC1.
What is the InChIKey of N-[[1-(2-methoxyethyl)cyclopropyl]methyl]thieno[3,2-c]pyridin-4-amine?
The InChIKey is GBVIHLHTHRTMMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2OS/c1-17-8-6-14(4-5-14)10-16-13-11-3-9-18-12(11)2-7-15-13/h2-3,7,9H,4-6,8,10H2,1H3,(H,15,16).
What are the key properties of N-[[1-(2-methoxyethyl)cyclopropyl]methyl]thieno[3,2-c]pyridin-4-amine?
N-[[1-(2-methoxyethyl)cyclopropyl]methyl]thieno[3,2-c]pyridin-4-amine has a molecular weight of 262.38 g/mol, XLogP of 3.52, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2-methoxyethyl)cyclopropyl]methyl]thieno[3,2-c]pyridin-4-amine is sourced from PubChem (CID 103794661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).