N-[(S)-cyclopropyl(1,3-thiazol-2-yl)methyl]-1-pyrazin-2-ylpiperidine-4-carboxamide

C17H21N5OS — CID 124607694

IUPACN-[(S)-cyclopropyl(1,3-thiazol-2-yl)methyl]-1-pyrazin-2-ylpiperidine-4-carboxamide
SMILESO=C(N[C@H](c1nccs1)C1CC1)C1CCN(c2cnccn2)CC1
InChIInChI=1S/C17H21N5OS/c23-16(21-15(12-1-2-12)17-20-7-10-24-17)13-3-8-22(9-4-13)14-11-18-5-6-19-14/h5-7,10-13,15H,1-4,8-9H2,(H,21,23)/t15-/m0/s1
InChIKeyFUGKBEXHDRQWQJ-HNNXBMFYSA-N
MW343.46 g/mol
LogP2.42
Rot. Bonds5

About N-[(S)-cyclopropyl(1,3-thiazol-2-yl)methyl]-1-pyrazin-2-ylpiperidine-4-carboxamide

N-[(S)-cyclopropyl(1,3-thiazol-2-yl)methyl]-1-pyrazin-2-ylpiperidine-4-carboxamide (PubChem CID 124607694) has the molecular formula C17H21N5OS and a molecular weight of 343.46 g/mol. Its IUPAC name is N-[(S)-cyclopropyl(1,3-thiazol-2-yl)methyl]-1-pyrazin-2-ylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-[(S)-cyclopropyl(1,3-thiazol-2-yl)methyl]-1-pyrazin-2-ylpiperidine-4-carboxamide
PubChem CID124607694
Molecular FormulaC17H21N5OS
Molecular Weight343.46 g/mol
Exact Mass343.15
IUPAC NameN-[(S)-cyclopropyl(1,3-thiazol-2-yl)methyl]-1-pyrazin-2-ylpiperidine-4-carboxamide
SMILESO=C(N[C@H](c1nccs1)C1CC1)C1CCN(c2cnccn2)CC1
InChIInChI=1S/C17H21N5OS/c23-16(21-15(12-1-2-12)17-20-7-10-24-17)13-3-8-22(9-4-13)14-11-18-5-6-19-14/h5-7,10-13,15H,1-4,8-9H2,(H,21,23)/t15-/m0/s1
InChIKeyFUGKBEXHDRQWQJ-HNNXBMFYSA-N
XLogP2.42
TPSA71.01 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.46
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(3S)-3-[(1-pyrazin-2-ylpiperidine-4-carbonyl)amino]-3-thiophen-2-ylpropanoic acid
CID 124705094
N-[(1S)-2-methyl-1-(4-propan-2-ylphenyl)propyl]-1-pyrazin-2-ylpiperidine-4-carboxamide
CID 39629575
N-[(R)-[1-(2-methylpyrimidin-4-yl)piperidin-4-yl]-(1,3-thiazol-2-yl)methyl]acetamide
CID 124989644
N-[(S)-cyclopropyl(1,3-thiazol-2-yl)methyl]-4-propan-2-ylpiperidine-1-carboxamide
CID 95968029
N-[2-[[(S)-cyclopropyl(1,3-thiazol-2-yl)methyl]carbamoylamino]ethyl]cyclopentanecarboxamide
CID 97219025
1-pyrazin-2-yl-N-(1-pyrimidin-2-ylpiperidin-4-yl)piperidine-4-carboxamide
CID 23609685
N-(2-methylbutan-2-yl)-1-pyrazin-2-ylpiperidine-4-carboxamide
CID 3222636
4-cyclopropyl-N-[cyclopropyl(1,3-thiazol-2-yl)methyl]piperazine-1-carboxamide
CID 75375387
N-[(1R)-2-methyl-1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-1-pyrazin-2-ylpiperidine-4-carboxamide
CID 129379229
N-[[4-[(R)-(cyclopropanecarbonylamino)-(1,3-thiazol-2-yl)methyl]cyclohexyl]methyl]-1-methyl-6-oxopyridine-3-carboxamide
CID 98077259
(1R,2S,4S)-N-[(S)-cyclopropyl(1,3-thiazol-2-yl)methyl]bicyclo[2.2.1]hept-5-ene-2-carboxamide
CID 98187618
N-[3-[[cyclopropyl(1,3-thiazol-2-yl)methyl]carbamoylamino]propyl]cyclobutanecarboxamide
CID 71978867

Frequently Asked Questions

What is the IUPAC name of N-[(S)-cyclopropyl(1,3-thiazol-2-yl)methyl]-1-pyrazin-2-ylpiperidine-4-carboxamide?
The IUPAC name of N-[(S)-cyclopropyl(1,3-thiazol-2-yl)methyl]-1-pyrazin-2-ylpiperidine-4-carboxamide (CID 124607694) is N-[(S)-cyclopropyl(1,3-thiazol-2-yl)methyl]-1-pyrazin-2-ylpiperidine-4-carboxamide.
What is the SMILES notation for N-[(S)-cyclopropyl(1,3-thiazol-2-yl)methyl]-1-pyrazin-2-ylpiperidine-4-carboxamide?
The canonical SMILES for N-[(S)-cyclopropyl(1,3-thiazol-2-yl)methyl]-1-pyrazin-2-ylpiperidine-4-carboxamide is O=C(N[C@H](c1nccs1)C1CC1)C1CCN(c2cnccn2)CC1.
What is the InChIKey of N-[(S)-cyclopropyl(1,3-thiazol-2-yl)methyl]-1-pyrazin-2-ylpiperidine-4-carboxamide?
The InChIKey is FUGKBEXHDRQWQJ-HNNXBMFYSA-N. The full InChI is InChI=1S/C17H21N5OS/c23-16(21-15(12-1-2-12)17-20-7-10-24-17)13-3-8-22(9-4-13)14-11-18-5-6-19-14/h5-7,10-13,15H,1-4,8-9H2,(H,21,23)/t15-/m0/s1.
What are the key properties of N-[(S)-cyclopropyl(1,3-thiazol-2-yl)methyl]-1-pyrazin-2-ylpiperidine-4-carboxamide?
N-[(S)-cyclopropyl(1,3-thiazol-2-yl)methyl]-1-pyrazin-2-ylpiperidine-4-carboxamide has a molecular weight of 343.46 g/mol, XLogP of 2.42, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(S)-cyclopropyl(1,3-thiazol-2-yl)methyl]-1-pyrazin-2-ylpiperidine-4-carboxamide is sourced from PubChem (CID 124607694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).