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

C13H16N2OS — CID 103989642

IUPACN-[(1-methoxycyclobutyl)methyl]thieno[3,2-c]pyridin-4-amine
SMILESCOC1(CNc2nccc3sccc23)CCC1
InChIInChI=1S/C13H16N2OS/c1-16-13(5-2-6-13)9-15-12-10-4-8-17-11(10)3-7-14-12/h3-4,7-8H,2,5-6,9H2,1H3,(H,14,15)
InChIKeyIWJZPMXZELCYSX-UHFFFAOYSA-N
MW248.35 g/mol
LogP3.28
Rot. Bonds4

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

N-[(1-methoxycyclobutyl)methyl]thieno[3,2-c]pyridin-4-amine (PubChem CID 103989642) has the molecular formula C13H16N2OS and a molecular weight of 248.35 g/mol. Its IUPAC name is N-[(1-methoxycyclobutyl)methyl]thieno[3,2-c]pyridin-4-amine.

Molecular Properties

Compound NameN-[(1-methoxycyclobutyl)methyl]thieno[3,2-c]pyridin-4-amine
PubChem CID103989642
Molecular FormulaC13H16N2OS
Molecular Weight248.35 g/mol
Exact Mass248.10
IUPAC NameN-[(1-methoxycyclobutyl)methyl]thieno[3,2-c]pyridin-4-amine
SMILESCOC1(CNc2nccc3sccc23)CCC1
InChIInChI=1S/C13H16N2OS/c1-16-13(5-2-6-13)9-15-12-10-4-8-17-11(10)3-7-14-12/h3-4,7-8H,2,5-6,9H2,1H3,(H,14,15)
InChIKeyIWJZPMXZELCYSX-UHFFFAOYSA-N
XLogP3.28
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.35
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1-methylcyclopentyl)methyl]thieno[3,2-c]pyridin-4-amine
CID 55261967
N-[[1-(2-methoxyethyl)cyclopropyl]methyl]thieno[3,2-c]pyridin-4-amine
CID 103794661
N-[(2-methylthiolan-2-yl)methyl]thieno[3,2-c]pyridin-4-amine
CID 80527912
N-[[1-(chloromethyl)cyclopentyl]methyl]thieno[3,2-c]pyridin-4-amine
CID 113294681
[1-[(thieno[3,2-c]pyridin-4-ylamino)methyl]cyclohexyl]methanol
CID 112697561
N-(2,2-dimethoxyethyl)thieno[3,2-c]pyridin-4-amine
CID 107390126
N-(2-methoxyethyl)-N'-thieno[3,2-c]pyridin-4-ylethane-1,2-diamine
CID 83029559
N-(2-cyclopentyloxyethyl)thieno[3,2-c]pyridin-4-amine
CID 55219716
[1-(thieno[3,2-c]pyridin-4-ylamino)cyclopentyl]methanol
CID 62519052
N-tert-butylthieno[3,2-c]pyridin-4-amine
CID 126975731
N-(2,3,3-trimethylbutyl)thieno[3,2-c]pyridin-4-amine
CID 83143600
2-methoxy-3-(thieno[3,2-c]pyridin-4-ylamino)propanoic acid
CID 106108525

Frequently Asked Questions

What is the IUPAC name of N-[(1-methoxycyclobutyl)methyl]thieno[3,2-c]pyridin-4-amine?
The IUPAC name of N-[(1-methoxycyclobutyl)methyl]thieno[3,2-c]pyridin-4-amine (CID 103989642) is N-[(1-methoxycyclobutyl)methyl]thieno[3,2-c]pyridin-4-amine.
What is the SMILES notation for N-[(1-methoxycyclobutyl)methyl]thieno[3,2-c]pyridin-4-amine?
The canonical SMILES for N-[(1-methoxycyclobutyl)methyl]thieno[3,2-c]pyridin-4-amine is COC1(CNc2nccc3sccc23)CCC1.
What is the InChIKey of N-[(1-methoxycyclobutyl)methyl]thieno[3,2-c]pyridin-4-amine?
The InChIKey is IWJZPMXZELCYSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2OS/c1-16-13(5-2-6-13)9-15-12-10-4-8-17-11(10)3-7-14-12/h3-4,7-8H,2,5-6,9H2,1H3,(H,14,15).
What are the key properties of N-[(1-methoxycyclobutyl)methyl]thieno[3,2-c]pyridin-4-amine?
N-[(1-methoxycyclobutyl)methyl]thieno[3,2-c]pyridin-4-amine has a molecular weight of 248.35 g/mol, XLogP of 3.28, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methoxycyclobutyl)methyl]thieno[3,2-c]pyridin-4-amine is sourced from PubChem (CID 103989642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).