4-ethyl-5-propyl-N-(pyrrolidin-2-ylmethyl)thiophene-2-carboxamide;hydrochloride

C15H25ClN2OS — CID 119511984

IUPAC4-ethyl-5-propyl-N-(pyrrolidin-2-ylmethyl)thiophene-2-carboxamide;hydrochloride
SMILESCCCc1sc(C(=O)NCC2CCCN2)cc1CC.Cl
InChIInChI=1S/C15H24N2OS.ClH/c1-3-6-13-11(4-2)9-14(19-13)15(18)17-10-12-7-5-8-16-12;/h9,12,16H,3-8,10H2,1-2H3,(H,17,18);1H
InChIKeyJWLFAUITGITESV-UHFFFAOYSA-N
MW316.90 g/mol
LogP3.17
Rot. Bonds6

About 4-ethyl-5-propyl-N-(pyrrolidin-2-ylmethyl)thiophene-2-carboxamide;hydrochloride

4-ethyl-5-propyl-N-(pyrrolidin-2-ylmethyl)thiophene-2-carboxamide;hydrochloride (PubChem CID 119511984) has the molecular formula C15H25ClN2OS and a molecular weight of 316.90 g/mol. Its IUPAC name is 4-ethyl-5-propyl-N-(pyrrolidin-2-ylmethyl)thiophene-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name4-ethyl-5-propyl-N-(pyrrolidin-2-ylmethyl)thiophene-2-carboxamide;hydrochloride
PubChem CID119511984
Molecular FormulaC15H25ClN2OS
Molecular Weight316.90 g/mol
Exact Mass316.14
IUPAC Name4-ethyl-5-propyl-N-(pyrrolidin-2-ylmethyl)thiophene-2-carboxamide;hydrochloride
SMILESCCCc1sc(C(=O)NCC2CCCN2)cc1CC.Cl
InChIInChI=1S/C15H24N2OS.ClH/c1-3-6-13-11(4-2)9-14(19-13)15(18)17-10-12-7-5-8-16-12;/h9,12,16H,3-8,10H2,1-2H3,(H,17,18);1H
InChIKeyJWLFAUITGITESV-UHFFFAOYSA-N
XLogP3.17
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.90
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-(pyrrolidin-2-ylmethyl)-1,3-thiazole-5-carboxamide;hydrochloride
CID 119514702
N-[2-(cyclohexanecarbonylamino)ethyl]-4-ethyl-5-propylthiophene-2-carboxamide
CID 55806350
4,5-dibromo-N-(piperidin-2-ylmethyl)thiophene-2-carboxamide
CID 80537490
2-[(4-ethyl-5-propylthiophene-2-carbonyl)amino]acetic acid
CID 43354383
4-ethyl-N-[2-(methylamino)ethyl]-5-propylthiophene-2-carboxamide
CID 119501880
3-ethyl-N-(pyrrolidin-2-ylmethyl)thiophene-2-carboxamide
CID 62541792
5-bromo-N-(pyrrolidin-2-ylmethyl)thiophene-2-carboxamide;hydrochloride
CID 119513668
1,3-dimethyl-N-(pyrrolidin-2-ylmethyl)thieno[3,2-d]pyrazole-5-carboxamide
CID 119512490
4-ethyl-N-(pyrrolidin-2-ylmethyl)thiadiazole-5-carboxamide;hydrochloride
CID 119510567
4-ethyl-N-(3-methylcyclopentyl)-5-propylthiophene-2-carboxamide
CID 114549705
4-ethyl-N-(1-methylpiperidin-4-yl)-5-propylthiophene-2-carboxamide
CID 47114418
3-ethyl-1-methyl-N-(pyrrolidin-2-ylmethyl)pyrazole-5-carboxamide
CID 66122699

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-5-propyl-N-(pyrrolidin-2-ylmethyl)thiophene-2-carboxamide;hydrochloride?
The IUPAC name of 4-ethyl-5-propyl-N-(pyrrolidin-2-ylmethyl)thiophene-2-carboxamide;hydrochloride (CID 119511984) is 4-ethyl-5-propyl-N-(pyrrolidin-2-ylmethyl)thiophene-2-carboxamide;hydrochloride.
What is the SMILES notation for 4-ethyl-5-propyl-N-(pyrrolidin-2-ylmethyl)thiophene-2-carboxamide;hydrochloride?
The canonical SMILES for 4-ethyl-5-propyl-N-(pyrrolidin-2-ylmethyl)thiophene-2-carboxamide;hydrochloride is CCCc1sc(C(=O)NCC2CCCN2)cc1CC.Cl.
What is the InChIKey of 4-ethyl-5-propyl-N-(pyrrolidin-2-ylmethyl)thiophene-2-carboxamide;hydrochloride?
The InChIKey is JWLFAUITGITESV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2OS.ClH/c1-3-6-13-11(4-2)9-14(19-13)15(18)17-10-12-7-5-8-16-12;/h9,12,16H,3-8,10H2,1-2H3,(H,17,18);1H.
What are the key properties of 4-ethyl-5-propyl-N-(pyrrolidin-2-ylmethyl)thiophene-2-carboxamide;hydrochloride?
4-ethyl-5-propyl-N-(pyrrolidin-2-ylmethyl)thiophene-2-carboxamide;hydrochloride has a molecular weight of 316.90 g/mol, XLogP of 3.17, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-5-propyl-N-(pyrrolidin-2-ylmethyl)thiophene-2-carboxamide;hydrochloride is sourced from PubChem (CID 119511984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).