3-(piperidine-1-carbonyl)-N-propyl-N-(thiophen-3-ylmethyl)pyrazine-2-carboxamide

C19H24N4O2S — CID 74245601

IUPAC3-(piperidine-1-carbonyl)-N-propyl-N-(thiophen-3-ylmethyl)pyrazine-2-carboxamide
SMILESCCCN(Cc1ccsc1)C(=O)c1nccnc1C(=O)N1CCCCC1
InChIInChI=1S/C19H24N4O2S/c1-2-9-23(13-15-6-12-26-14-15)19(25)17-16(20-7-8-21-17)18(24)22-10-4-3-5-11-22/h6-8,12,14H,2-5,9-11,13H2,1H3
InChIKeyQHCBGAXPFQPTIV-UHFFFAOYSA-N
MW372.49 g/mol
LogP3.22
Rot. Bonds6

About 3-(piperidine-1-carbonyl)-N-propyl-N-(thiophen-3-ylmethyl)pyrazine-2-carboxamide

3-(piperidine-1-carbonyl)-N-propyl-N-(thiophen-3-ylmethyl)pyrazine-2-carboxamide (PubChem CID 74245601) has the molecular formula C19H24N4O2S and a molecular weight of 372.49 g/mol. Its IUPAC name is 3-(piperidine-1-carbonyl)-N-propyl-N-(thiophen-3-ylmethyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name3-(piperidine-1-carbonyl)-N-propyl-N-(thiophen-3-ylmethyl)pyrazine-2-carboxamide
PubChem CID74245601
Molecular FormulaC19H24N4O2S
Molecular Weight372.49 g/mol
Exact Mass372.16
IUPAC Name3-(piperidine-1-carbonyl)-N-propyl-N-(thiophen-3-ylmethyl)pyrazine-2-carboxamide
SMILESCCCN(Cc1ccsc1)C(=O)c1nccnc1C(=O)N1CCCCC1
InChIInChI=1S/C19H24N4O2S/c1-2-9-23(13-15-6-12-26-14-15)19(25)17-16(20-7-8-21-17)18(24)22-10-4-3-5-11-22/h6-8,12,14H,2-5,9-11,13H2,1H3
InChIKeyQHCBGAXPFQPTIV-UHFFFAOYSA-N
XLogP3.22
TPSA66.40 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.49
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-propyl-2-pyridin-3-yl-2-pyrrolidin-1-yl-N-(thiophen-3-ylmethyl)acetamide
CID 72837629
azepan-1-yl-[(5S)-1-methyl-5-[methyl(thiophen-3-ylmethyl)amino]-4,5,6,7-tetrahydroindazol-3-yl]methanone
CID 26145085
6-(azepane-1-carbonyl)-N,N-dipropylpyridine-2-carboxamide
CID 109099778
1-(azocan-1-yl)-2-thiophen-3-ylethanone
CID 112769654
N-butyl-N-(thiophen-3-ylmethyl)-1,8-naphthyridine-2-carboxamide
CID 50963964
4-(azepane-1-carbonyl)-N-benzyl-N-ethylpyridine-2-carboxamide
CID 109087072
[2-(dipropylamino)pyrimidin-4-yl]-piperidin-1-ylmethanone
CID 109298477
pyrrolidin-1-yl-[4-(thiophen-3-ylmethoxy)phenyl]methanone
CID 126830676
N-[(5-ethyl-1,3,4-thiadiazol-2-yl)methyl]-3-(piperidine-1-carbonyl)pyrazine-2-carboxamide
CID 118791672
N-[(3-aminophenyl)methyl]-N-propylpyrrolidine-1-carboxamide
CID 79160910
N-(thiophen-3-ylmethyl)azetidine-1-carboxamide
CID 130650634
2-[[methyl(thiophen-3-ylmethyl)carbamoyl]-propylamino]acetic acid
CID 61197925

Frequently Asked Questions

What is the IUPAC name of 3-(piperidine-1-carbonyl)-N-propyl-N-(thiophen-3-ylmethyl)pyrazine-2-carboxamide?
The IUPAC name of 3-(piperidine-1-carbonyl)-N-propyl-N-(thiophen-3-ylmethyl)pyrazine-2-carboxamide (CID 74245601) is 3-(piperidine-1-carbonyl)-N-propyl-N-(thiophen-3-ylmethyl)pyrazine-2-carboxamide.
What is the SMILES notation for 3-(piperidine-1-carbonyl)-N-propyl-N-(thiophen-3-ylmethyl)pyrazine-2-carboxamide?
The canonical SMILES for 3-(piperidine-1-carbonyl)-N-propyl-N-(thiophen-3-ylmethyl)pyrazine-2-carboxamide is CCCN(Cc1ccsc1)C(=O)c1nccnc1C(=O)N1CCCCC1.
What is the InChIKey of 3-(piperidine-1-carbonyl)-N-propyl-N-(thiophen-3-ylmethyl)pyrazine-2-carboxamide?
The InChIKey is QHCBGAXPFQPTIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2S/c1-2-9-23(13-15-6-12-26-14-15)19(25)17-16(20-7-8-21-17)18(24)22-10-4-3-5-11-22/h6-8,12,14H,2-5,9-11,13H2,1H3.
What are the key properties of 3-(piperidine-1-carbonyl)-N-propyl-N-(thiophen-3-ylmethyl)pyrazine-2-carboxamide?
3-(piperidine-1-carbonyl)-N-propyl-N-(thiophen-3-ylmethyl)pyrazine-2-carboxamide has a molecular weight of 372.49 g/mol, XLogP of 3.22, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(piperidine-1-carbonyl)-N-propyl-N-(thiophen-3-ylmethyl)pyrazine-2-carboxamide is sourced from PubChem (CID 74245601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).