3-(cyclohexylmethoxy)-5-(2-piperidin-4-yl-1,3-thiazol-5-yl)pyridin-2-amine

C20H28N4OS — CID 162659020

IUPAC3-(cyclohexylmethoxy)-5-(2-piperidin-4-yl-1,3-thiazol-5-yl)pyridin-2-amine
SMILESNc1ncc(-c2cnc(C3CCNCC3)s2)cc1OCC1CCCCC1
InChIInChI=1S/C20H28N4OS/c21-19-17(25-13-14-4-2-1-3-5-14)10-16(11-23-19)18-12-24-20(26-18)15-6-8-22-9-7-15/h10-12,14-15,22H,1-9,13H2,(H2,21,23)
InChIKeyKOUGNLUUPLSUAG-UHFFFAOYSA-N
MW372.54 g/mol
LogP4.21
Rot. Bonds5

About 3-(cyclohexylmethoxy)-5-(2-piperidin-4-yl-1,3-thiazol-5-yl)pyridin-2-amine

3-(cyclohexylmethoxy)-5-(2-piperidin-4-yl-1,3-thiazol-5-yl)pyridin-2-amine (PubChem CID 162659020) has the molecular formula C20H28N4OS and a molecular weight of 372.54 g/mol. Its IUPAC name is 3-(cyclohexylmethoxy)-5-(2-piperidin-4-yl-1,3-thiazol-5-yl)pyridin-2-amine.

Molecular Properties

Compound Name3-(cyclohexylmethoxy)-5-(2-piperidin-4-yl-1,3-thiazol-5-yl)pyridin-2-amine
PubChem CID162659020
Molecular FormulaC20H28N4OS
Molecular Weight372.54 g/mol
Exact Mass372.20
IUPAC Name3-(cyclohexylmethoxy)-5-(2-piperidin-4-yl-1,3-thiazol-5-yl)pyridin-2-amine
SMILESNc1ncc(-c2cnc(C3CCNCC3)s2)cc1OCC1CCCCC1
InChIInChI=1S/C20H28N4OS/c21-19-17(25-13-14-4-2-1-3-5-14)10-16(11-23-19)18-12-24-20(26-18)15-6-8-22-9-7-15/h10-12,14-15,22H,1-9,13H2,(H2,21,23)
InChIKeyKOUGNLUUPLSUAG-UHFFFAOYSA-N
XLogP4.21
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.54
LogP ≤ 54.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-{3-[({2-Amino-5-[2-(1-methylpiperidin-4-yl)-1,3-thiazol-5-yl]pyridin-3-yl}oxy)methyl]phenyl}-2-methylbut-3-yn-2-ol
CID 155905549
Hpk1-IN-26
CID 122197569
N-(3-methoxypyridin-2-yl)-5-phenyl-1,3-thiazol-2-amine
CID 5329397
3-(Benzyloxy)-N-(4-Methyl-1,3-Thiazol-2-Yl)pyridin-2-Amine
CID 16660015
3-(Benzyloxy)-5-Methyl-N-(4-Methyl-1,3-Thiazol-2-Yl)pyridin-2-Amine
CID 59225669
5-[2-(1-Ethylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-(pyridin-4-ylmethoxy)pyridin-2-amine
CID 162672976
3-(benzyloxy)-5-(benzylthio)-N-(4-methylthiazol-2-yl)pyridin-2-amine
CID 16660174
3-(benzyloxy)-N-(4-methylthiazol-2-yl)-5-(pyridin-2-ylmethylthio)pyridin-2-amine
CID 16660507
4-methyl-N-(3-phenylmethoxy-5-pyridin-2-ylsulfanyl-2-pyridinyl)-1,3-thiazol-2-amine
CID 16660671
N-(5-benzylsulfanyl-3-phenoxy-2-pyridinyl)-4-methyl-1,3-thiazol-2-amine
CID 24765640
4-cyclohexyl-N-(3-phenoxy-5-pyridin-4-ylsulfanyl-2-pyridinyl)-1,3-thiazol-2-amine
CID 57742658
N-(3-phenoxy-5-pyridin-4-ylsulfanyl-2-pyridinyl)-4-(2-phenylethyl)-1,3-thiazol-2-amine
CID 57742806

Frequently Asked Questions

What is the IUPAC name of 3-(cyclohexylmethoxy)-5-(2-piperidin-4-yl-1,3-thiazol-5-yl)pyridin-2-amine?
The IUPAC name of 3-(cyclohexylmethoxy)-5-(2-piperidin-4-yl-1,3-thiazol-5-yl)pyridin-2-amine (CID 162659020) is 3-(cyclohexylmethoxy)-5-(2-piperidin-4-yl-1,3-thiazol-5-yl)pyridin-2-amine.
What is the SMILES notation for 3-(cyclohexylmethoxy)-5-(2-piperidin-4-yl-1,3-thiazol-5-yl)pyridin-2-amine?
The canonical SMILES for 3-(cyclohexylmethoxy)-5-(2-piperidin-4-yl-1,3-thiazol-5-yl)pyridin-2-amine is Nc1ncc(-c2cnc(C3CCNCC3)s2)cc1OCC1CCCCC1.
What is the InChIKey of 3-(cyclohexylmethoxy)-5-(2-piperidin-4-yl-1,3-thiazol-5-yl)pyridin-2-amine?
The InChIKey is KOUGNLUUPLSUAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N4OS/c21-19-17(25-13-14-4-2-1-3-5-14)10-16(11-23-19)18-12-24-20(26-18)15-6-8-22-9-7-15/h10-12,14-15,22H,1-9,13H2,(H2,21,23).
What are the key properties of 3-(cyclohexylmethoxy)-5-(2-piperidin-4-yl-1,3-thiazol-5-yl)pyridin-2-amine?
3-(cyclohexylmethoxy)-5-(2-piperidin-4-yl-1,3-thiazol-5-yl)pyridin-2-amine has a molecular weight of 372.54 g/mol, XLogP of 4.21, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclohexylmethoxy)-5-(2-piperidin-4-yl-1,3-thiazol-5-yl)pyridin-2-amine is sourced from PubChem (CID 162659020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).