2-(2,3-dihydro-1H-indene-5-carbonylamino)-N-piperidin-4-ylthiophene-3-carboxamide

C20H23N3O2S — CID 119388601

IUPAC2-(2,3-dihydro-1H-indene-5-carbonylamino)-N-piperidin-4-ylthiophene-3-carboxamide
SMILESO=C(Nc1sccc1C(=O)NC1CCNCC1)c1ccc2c(c1)CCC2
InChIInChI=1S/C20H23N3O2S/c24-18(15-5-4-13-2-1-3-14(13)12-15)23-20-17(8-11-26-20)19(25)22-16-6-9-21-10-7-16/h4-5,8,11-12,16,21H,1-3,6-7,9-10H2,(H,22,25)(H,23,24)
InChIKeyURJYCDYGFLRQQY-UHFFFAOYSA-N
MW369.49 g/mol
LogP2.97
Rot. Bonds4

About 2-(2,3-dihydro-1H-indene-5-carbonylamino)-N-piperidin-4-ylthiophene-3-carboxamide

2-(2,3-dihydro-1H-indene-5-carbonylamino)-N-piperidin-4-ylthiophene-3-carboxamide (PubChem CID 119388601) has the molecular formula C20H23N3O2S and a molecular weight of 369.49 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-indene-5-carbonylamino)-N-piperidin-4-ylthiophene-3-carboxamide.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-indene-5-carbonylamino)-N-piperidin-4-ylthiophene-3-carboxamide
PubChem CID119388601
Molecular FormulaC20H23N3O2S
Molecular Weight369.49 g/mol
Exact Mass369.15
IUPAC Name2-(2,3-dihydro-1H-indene-5-carbonylamino)-N-piperidin-4-ylthiophene-3-carboxamide
SMILESO=C(Nc1sccc1C(=O)NC1CCNCC1)c1ccc2c(c1)CCC2
InChIInChI=1S/C20H23N3O2S/c24-18(15-5-4-13-2-1-3-14(13)12-15)23-20-17(8-11-26-20)19(25)22-16-6-9-21-10-7-16/h4-5,8,11-12,16,21H,1-3,6-7,9-10H2,(H,22,25)(H,23,24)
InChIKeyURJYCDYGFLRQQY-UHFFFAOYSA-N
XLogP2.97
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.49
LogP ≤ 52.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,3-dihydro-1H-indene-5-carbonylamino)-N-(3-methylpiperidin-4-yl)thiophene-3-carboxamide
CID 120556634
2-(2,3-dihydro-1H-indene-5-carbonylamino)-N-(piperidin-3-ylmethyl)thiophene-3-carboxamide
CID 119462719
N-[3-(3-methylpiperazine-1-carbonyl)thiophen-2-yl]-2,3-dihydro-1H-indene-5-carboxamide
CID 119579024
N-(2-amino-1-cyclopropylethyl)-2-(2,3-dihydro-1H-indene-5-carbonylamino)thiophene-3-carboxamide;hydrochloride
CID 119615790
2-[(4-propan-2-ylbenzoyl)amino]-N-pyrrolidin-3-ylthiophene-3-carboxamide
CID 119449720
N-[3-[4-(aminomethyl)piperidine-1-carbonyl]thiophen-2-yl]-2,3-dihydro-1H-indene-5-carboxamide
CID 119423582
N-piperidin-4-yl-1,2,3,4-tetrahydroisoquinoline-6-carboxamide
CID 110489063
N-[3-[3-(aminomethyl)pyrrolidine-1-carbonyl]thiophen-2-yl]-2,3-dihydro-1H-indene-5-carboxamide
CID 119485689
N-cyclopropyl-2-[(3-methoxy-4-methylbenzoyl)amino]thiophene-3-carboxamide
CID 60590871
3-[[2-(2,3-dihydro-1H-indene-5-carbonylamino)thiophene-3-carbonyl]-methylamino]propanoic acid
CID 119362239
N-(azepan-4-yl)-1,3-dihydro-2-benzofuran-5-carboxamide
CID 105060018
N-[3-[3-(diethylamino)pyrrolidine-1-carbonyl]thiophen-2-yl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 154840874

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-indene-5-carbonylamino)-N-piperidin-4-ylthiophene-3-carboxamide?
The IUPAC name of 2-(2,3-dihydro-1H-indene-5-carbonylamino)-N-piperidin-4-ylthiophene-3-carboxamide (CID 119388601) is 2-(2,3-dihydro-1H-indene-5-carbonylamino)-N-piperidin-4-ylthiophene-3-carboxamide.
What is the SMILES notation for 2-(2,3-dihydro-1H-indene-5-carbonylamino)-N-piperidin-4-ylthiophene-3-carboxamide?
The canonical SMILES for 2-(2,3-dihydro-1H-indene-5-carbonylamino)-N-piperidin-4-ylthiophene-3-carboxamide is O=C(Nc1sccc1C(=O)NC1CCNCC1)c1ccc2c(c1)CCC2.
What is the InChIKey of 2-(2,3-dihydro-1H-indene-5-carbonylamino)-N-piperidin-4-ylthiophene-3-carboxamide?
The InChIKey is URJYCDYGFLRQQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O2S/c24-18(15-5-4-13-2-1-3-14(13)12-15)23-20-17(8-11-26-20)19(25)22-16-6-9-21-10-7-16/h4-5,8,11-12,16,21H,1-3,6-7,9-10H2,(H,22,25)(H,23,24).
What are the key properties of 2-(2,3-dihydro-1H-indene-5-carbonylamino)-N-piperidin-4-ylthiophene-3-carboxamide?
2-(2,3-dihydro-1H-indene-5-carbonylamino)-N-piperidin-4-ylthiophene-3-carboxamide has a molecular weight of 369.49 g/mol, XLogP of 2.97, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-indene-5-carbonylamino)-N-piperidin-4-ylthiophene-3-carboxamide is sourced from PubChem (CID 119388601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).