1-(3-methylthiophene-2-carbonyl)-N-propan-2-ylpiperidine-4-carboxamide

C15H22N2O2S — CID 91954030

IUPAC1-(3-methylthiophene-2-carbonyl)-N-propan-2-ylpiperidine-4-carboxamide
SMILESCc1ccsc1C(=O)N1CCC(C(=O)NC(C)C)CC1
InChIInChI=1S/C15H22N2O2S/c1-10(2)16-14(18)12-4-7-17(8-5-12)15(19)13-11(3)6-9-20-13/h6,9-10,12H,4-5,7-8H2,1-3H3,(H,16,18)
InChIKeyCIPNFYVPXXBABO-UHFFFAOYSA-N
MW294.42 g/mol
LogP2.43
Rot. Bonds3

About 1-(3-methylthiophene-2-carbonyl)-N-propan-2-ylpiperidine-4-carboxamide

1-(3-methylthiophene-2-carbonyl)-N-propan-2-ylpiperidine-4-carboxamide (PubChem CID 91954030) has the molecular formula C15H22N2O2S and a molecular weight of 294.42 g/mol. Its IUPAC name is 1-(3-methylthiophene-2-carbonyl)-N-propan-2-ylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(3-methylthiophene-2-carbonyl)-N-propan-2-ylpiperidine-4-carboxamide
PubChem CID91954030
Molecular FormulaC15H22N2O2S
Molecular Weight294.42 g/mol
Exact Mass294.14
IUPAC Name1-(3-methylthiophene-2-carbonyl)-N-propan-2-ylpiperidine-4-carboxamide
SMILESCc1ccsc1C(=O)N1CCC(C(=O)NC(C)C)CC1
InChIInChI=1S/C15H22N2O2S/c1-10(2)16-14(18)12-4-7-17(8-5-12)15(19)13-11(3)6-9-20-13/h6,9-10,12H,4-5,7-8H2,1-3H3,(H,16,18)
InChIKeyCIPNFYVPXXBABO-UHFFFAOYSA-N
XLogP2.43
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.42
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-methylthiophene-2-carbonyl)piperidine-4-carboxylic acid
CID 24704942
1-(3-methylthiophene-2-carbonyl)-N-phenylpiperidine-4-carboxamide
CID 17395338
(4-aminopiperidin-1-yl)-(3-methylthiophen-2-yl)methanone;hydrochloride
CID 71638229
(3-aminopyrrolidin-1-yl)-(3-methylthiophen-2-yl)methanone;hydrochloride
CID 71638228
(3-hydroxypyrrolidin-1-yl)-(3-methylthiophen-2-yl)methanone
CID 62916564
(4-methoxyphenyl)-[1-(3-methylthiophene-2-carbonyl)piperidin-4-yl]methanone
CID 25473895
2-[1-(3-methylthiophene-2-carbonyl)piperidin-4-yl]acetic acid
CID 78980342
[4-(cyclopropylmethylamino)piperidin-1-yl]-(3-methylthiophen-2-yl)methanone
CID 81483119
[2-(1-aminoethyl)piperidin-1-yl]-(3-methylthiophen-2-yl)methanone;hydrochloride
CID 119434857
1-(3-bromothiophene-2-carbonyl)-N-ethylpiperidine-4-carboxamide
CID 60777066
N-[[7-(3-methylthiophene-2-carbonyl)-5,6,8,9-tetrahydro-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl]methyl]cyclopropanecarboxamide
CID 42248539
1-(3-methylthiophene-2-carbonyl)piperidin-4-one
CID 24696594

Frequently Asked Questions

What is the IUPAC name of 1-(3-methylthiophene-2-carbonyl)-N-propan-2-ylpiperidine-4-carboxamide?
The IUPAC name of 1-(3-methylthiophene-2-carbonyl)-N-propan-2-ylpiperidine-4-carboxamide (CID 91954030) is 1-(3-methylthiophene-2-carbonyl)-N-propan-2-ylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(3-methylthiophene-2-carbonyl)-N-propan-2-ylpiperidine-4-carboxamide?
The canonical SMILES for 1-(3-methylthiophene-2-carbonyl)-N-propan-2-ylpiperidine-4-carboxamide is Cc1ccsc1C(=O)N1CCC(C(=O)NC(C)C)CC1.
What is the InChIKey of 1-(3-methylthiophene-2-carbonyl)-N-propan-2-ylpiperidine-4-carboxamide?
The InChIKey is CIPNFYVPXXBABO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2S/c1-10(2)16-14(18)12-4-7-17(8-5-12)15(19)13-11(3)6-9-20-13/h6,9-10,12H,4-5,7-8H2,1-3H3,(H,16,18).
What are the key properties of 1-(3-methylthiophene-2-carbonyl)-N-propan-2-ylpiperidine-4-carboxamide?
1-(3-methylthiophene-2-carbonyl)-N-propan-2-ylpiperidine-4-carboxamide has a molecular weight of 294.42 g/mol, XLogP of 2.43, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methylthiophene-2-carbonyl)-N-propan-2-ylpiperidine-4-carboxamide is sourced from PubChem (CID 91954030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).