(4-cyclopropyl-2-thieno[3,2-b]pyridin-6-yl-1,3-thiazol-5-yl)methanamine

C14H13N3S2 — CID 114361944

IUPAC(4-cyclopropyl-2-thieno[3,2-b]pyridin-6-yl-1,3-thiazol-5-yl)methanamine
SMILESNCc1sc(-c2cnc3ccsc3c2)nc1C1CC1
InChIInChI=1S/C14H13N3S2/c15-6-12-13(8-1-2-8)17-14(19-12)9-5-11-10(16-7-9)3-4-18-11/h3-5,7-8H,1-2,6,15H2
InChIKeyWNTXTZZIOLRWFL-UHFFFAOYSA-N
MW287.41 g/mol
LogP3.76
Rot. Bonds3

About (4-cyclopropyl-2-thieno[3,2-b]pyridin-6-yl-1,3-thiazol-5-yl)methanamine

(4-cyclopropyl-2-thieno[3,2-b]pyridin-6-yl-1,3-thiazol-5-yl)methanamine (PubChem CID 114361944) has the molecular formula C14H13N3S2 and a molecular weight of 287.41 g/mol. Its IUPAC name is (4-cyclopropyl-2-thieno[3,2-b]pyridin-6-yl-1,3-thiazol-5-yl)methanamine.

Molecular Properties

Compound Name(4-cyclopropyl-2-thieno[3,2-b]pyridin-6-yl-1,3-thiazol-5-yl)methanamine
PubChem CID114361944
Molecular FormulaC14H13N3S2
Molecular Weight287.41 g/mol
Exact Mass287.06
IUPAC Name(4-cyclopropyl-2-thieno[3,2-b]pyridin-6-yl-1,3-thiazol-5-yl)methanamine
SMILESNCc1sc(-c2cnc3ccsc3c2)nc1C1CC1
InChIInChI=1S/C14H13N3S2/c15-6-12-13(8-1-2-8)17-14(19-12)9-5-11-10(16-7-9)3-4-18-11/h3-5,7-8H,1-2,6,15H2
InChIKeyWNTXTZZIOLRWFL-UHFFFAOYSA-N
XLogP3.76
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(4-tert-butyl-2-thieno[3,2-b]pyridin-6-yl-1,3-thiazol-5-yl)methanamine
CID 114361075
(4-cyclopropyl-2-pyridin-4-yl-1,3-thiazol-5-yl)methanamine
CID 82436375
N-methyl-2-thieno[3,2-b]pyridin-6-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-4-amine
CID 81146821
6-cyclopropyl-2-thieno[3,2-b]pyridin-6-ylpyrimidin-4-amine
CID 81143436
[4-cyclopropyl-2-(3-fluoro-5-methylphenyl)-1,3-thiazol-5-yl]methanamine
CID 114361984
(4-cyclopropyl-2-pyridin-2-yl-1,3-thiazol-5-yl)methanamine
CID 82436315
N-[(2-thieno[3,2-b]pyridin-6-yl-1,3-thiazol-4-yl)methyl]ethanamine
CID 81143527
2-thieno[3,2-b]pyridin-6-yl-6,7-dihydro-5H-1,3-benzothiazol-4-one
CID 81143321
[4-cyclopropyl-2-[4-fluoro-2-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]methanamine
CID 114361920
1-(4-methyl-2-thieno[3,2-b]pyridin-6-yl-1,3-thiazol-5-yl)ethanone
CID 81143050
(2-thieno[3,2-b]pyridin-6-yl-5,6,7,8-tetrahydroquinazolin-6-yl)methanamine
CID 81424689
[4-cyclopropyl-2-(2-ethoxyphenyl)-1,3-thiazol-5-yl]methanamine
CID 82437246

Frequently Asked Questions

What is the IUPAC name of (4-cyclopropyl-2-thieno[3,2-b]pyridin-6-yl-1,3-thiazol-5-yl)methanamine?
The IUPAC name of (4-cyclopropyl-2-thieno[3,2-b]pyridin-6-yl-1,3-thiazol-5-yl)methanamine (CID 114361944) is (4-cyclopropyl-2-thieno[3,2-b]pyridin-6-yl-1,3-thiazol-5-yl)methanamine.
What is the SMILES notation for (4-cyclopropyl-2-thieno[3,2-b]pyridin-6-yl-1,3-thiazol-5-yl)methanamine?
The canonical SMILES for (4-cyclopropyl-2-thieno[3,2-b]pyridin-6-yl-1,3-thiazol-5-yl)methanamine is NCc1sc(-c2cnc3ccsc3c2)nc1C1CC1.
What is the InChIKey of (4-cyclopropyl-2-thieno[3,2-b]pyridin-6-yl-1,3-thiazol-5-yl)methanamine?
The InChIKey is WNTXTZZIOLRWFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3S2/c15-6-12-13(8-1-2-8)17-14(19-12)9-5-11-10(16-7-9)3-4-18-11/h3-5,7-8H,1-2,6,15H2.
What are the key properties of (4-cyclopropyl-2-thieno[3,2-b]pyridin-6-yl-1,3-thiazol-5-yl)methanamine?
(4-cyclopropyl-2-thieno[3,2-b]pyridin-6-yl-1,3-thiazol-5-yl)methanamine has a molecular weight of 287.41 g/mol, XLogP of 3.76, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4-cyclopropyl-2-thieno[3,2-b]pyridin-6-yl-1,3-thiazol-5-yl)methanamine is sourced from PubChem (CID 114361944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).