[4-methyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]-1,3-thiazol-5-yl]methanol

C15H25N3OS — CID 63009952

IUPAC[4-methyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]-1,3-thiazol-5-yl]methanol
SMILESCc1nc(N2CCC(CN3CCCC3)CC2)sc1CO
InChIInChI=1S/C15H25N3OS/c1-12-14(11-19)20-15(16-12)18-8-4-13(5-9-18)10-17-6-2-3-7-17/h13,19H,2-11H2,1H3
InChIKeyMULLPPNYEQPQMK-UHFFFAOYSA-N
MW295.45 g/mol
LogP2.26
Rot. Bonds4

About [4-methyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]-1,3-thiazol-5-yl]methanol

[4-methyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]-1,3-thiazol-5-yl]methanol (PubChem CID 63009952) has the molecular formula C15H25N3OS and a molecular weight of 295.45 g/mol. Its IUPAC name is [4-methyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Name[4-methyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]-1,3-thiazol-5-yl]methanol
PubChem CID63009952
Molecular FormulaC15H25N3OS
Molecular Weight295.45 g/mol
Exact Mass295.17
IUPAC Name[4-methyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]-1,3-thiazol-5-yl]methanol
SMILESCc1nc(N2CCC(CN3CCCC3)CC2)sc1CO
InChIInChI=1S/C15H25N3OS/c1-12-14(11-19)20-15(16-12)18-8-4-13(5-9-18)10-17-6-2-3-7-17/h13,19H,2-11H2,1H3
InChIKeyMULLPPNYEQPQMK-UHFFFAOYSA-N
XLogP2.26
TPSA39.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.45
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[2-[4-(methoxymethyl)piperidin-1-yl]-4-methyl-1,3-thiazol-5-yl]methanol
CID 63979536
[2-(4-ethoxypiperidin-1-yl)-4-methyl-1,3-thiazol-5-yl]methanol
CID 55117381
[2-(4-benzylpiperidin-1-yl)-4-methyl-1,3-thiazol-5-yl]methanol
CID 62779816
[4-methyl-2-(1-methyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridin-6-yl)-1,3-thiazol-5-yl]methanol
CID 81206184
N-[[2-[4-(cyclopropylmethyl)piperazin-1-yl]-4-methyl-1,3-thiazol-5-yl]methyl]propan-2-amine
CID 62780311
[4-methyl-2-(1,4-thiazepan-4-yl)-1,3-thiazol-5-yl]methanol
CID 62779519
[2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]-1,3-thiazol-5-yl]methanol
CID 63009431
[4-methyl-2-(2-methylpyrrolidin-1-yl)-1,3-thiazol-5-yl]methanol
CID 62780487
[4-methyl-2-(3-phenylpyrrolidin-1-yl)-1,3-thiazol-5-yl]methanol
CID 62780508
5-(bromomethyl)-4-methyl-2-pyrrolidin-1-yl-1,3-thiazole
CID 82427860
(4-methyl-2-piperidin-1-yl-1,3-thiazol-5-yl)methanamine
CID 46785718
[4-chloro-2-(4-propylazepan-1-yl)-1,3-thiazol-5-yl]methanol
CID 80692314

Frequently Asked Questions

What is the IUPAC name of [4-methyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]-1,3-thiazol-5-yl]methanol?
The IUPAC name of [4-methyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]-1,3-thiazol-5-yl]methanol (CID 63009952) is [4-methyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for [4-methyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]-1,3-thiazol-5-yl]methanol?
The canonical SMILES for [4-methyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]-1,3-thiazol-5-yl]methanol is Cc1nc(N2CCC(CN3CCCC3)CC2)sc1CO.
What is the InChIKey of [4-methyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]-1,3-thiazol-5-yl]methanol?
The InChIKey is MULLPPNYEQPQMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3OS/c1-12-14(11-19)20-15(16-12)18-8-4-13(5-9-18)10-17-6-2-3-7-17/h13,19H,2-11H2,1H3.
What are the key properties of [4-methyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]-1,3-thiazol-5-yl]methanol?
[4-methyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]-1,3-thiazol-5-yl]methanol has a molecular weight of 295.45 g/mol, XLogP of 2.26, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 63009952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).