3-amino-4-cyclopropyl-N-ethyl-5-(piperidin-4-ylamino)thiophene-2-carboxamide

C15H24N4OS — CID 103525554

IUPAC3-amino-4-cyclopropyl-N-ethyl-5-(piperidin-4-ylamino)thiophene-2-carboxamide
SMILESCCNC(=O)c1sc(NC2CCNCC2)c(C2CC2)c1N
InChIInChI=1S/C15H24N4OS/c1-2-18-14(20)13-12(16)11(9-3-4-9)15(21-13)19-10-5-7-17-8-6-10/h9-10,17,19H,2-8,16H2,1H3,(H,18,20)
InChIKeyDERWZGZSRWJBEK-UHFFFAOYSA-N
MW308.45 g/mol
LogP2.12
Rot. Bonds5

About 3-amino-4-cyclopropyl-N-ethyl-5-(piperidin-4-ylamino)thiophene-2-carboxamide

3-amino-4-cyclopropyl-N-ethyl-5-(piperidin-4-ylamino)thiophene-2-carboxamide (PubChem CID 103525554) has the molecular formula C15H24N4OS and a molecular weight of 308.45 g/mol. Its IUPAC name is 3-amino-4-cyclopropyl-N-ethyl-5-(piperidin-4-ylamino)thiophene-2-carboxamide.

Molecular Properties

Compound Name3-amino-4-cyclopropyl-N-ethyl-5-(piperidin-4-ylamino)thiophene-2-carboxamide
PubChem CID103525554
Molecular FormulaC15H24N4OS
Molecular Weight308.45 g/mol
Exact Mass308.17
IUPAC Name3-amino-4-cyclopropyl-N-ethyl-5-(piperidin-4-ylamino)thiophene-2-carboxamide
SMILESCCNC(=O)c1sc(NC2CCNCC2)c(C2CC2)c1N
InChIInChI=1S/C15H24N4OS/c1-2-18-14(20)13-12(16)11(9-3-4-9)15(21-13)19-10-5-7-17-8-6-10/h9-10,17,19H,2-8,16H2,1H3,(H,18,20)
InChIKeyDERWZGZSRWJBEK-UHFFFAOYSA-N
XLogP2.12
TPSA79.18 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.45
LogP ≤ 52.12
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

3-amino-4-cyano-N-ethyl-5-(piperidin-4-ylamino)thiophene-2-carboxamide
CID 103525501
3-amino-4-cyclopropyl-N-ethyl-5-(propylamino)thiophene-2-carboxamide
CID 103423180
1-[3-amino-5-(cyclopentylamino)-4-cyclopropylthiophen-2-yl]propan-1-one
CID 103423911
1-[3-amino-5-(cyclobutylamino)-4-cyclopropylthiophen-2-yl]propan-1-one
CID 103525907
3-amino-4-cyclopropyl-5-(cyclopropylamino)-N,N-dimethylthiophene-2-carboxamide
CID 103423662
1-[3-amino-4-cyclopropyl-5-(cyclopropylamino)thiophen-2-yl]-2-methylpropan-1-one
CID 103423663
3-amino-5-(azepan-1-yl)-4-cyclopropyl-N-ethylthiophene-2-carboxamide
CID 103419645
1-[3-amino-4-methoxy-5-(piperidin-4-ylamino)thiophen-2-yl]ethanone
CID 103525555
3-amino-N-methyl-5-(piperidin-4-ylamino)-4-propan-2-yloxythiophene-2-carboxamide
CID 103525562
1-[3-amino-4-methylsulfonyl-5-(piperidin-4-ylamino)thiophen-2-yl]propan-1-one
CID 103525531
3-amino-4-cyclopropyl-N-ethyl-5-[ethyl(2-methylpropyl)amino]thiophene-2-carboxamide
CID 103420839
3-amino-4-cyclopropyl-N-ethyl-5-[2-methoxyethyl(methyl)amino]thiophene-2-carboxamide
CID 103417786

Frequently Asked Questions

What is the IUPAC name of 3-amino-4-cyclopropyl-N-ethyl-5-(piperidin-4-ylamino)thiophene-2-carboxamide?
The IUPAC name of 3-amino-4-cyclopropyl-N-ethyl-5-(piperidin-4-ylamino)thiophene-2-carboxamide (CID 103525554) is 3-amino-4-cyclopropyl-N-ethyl-5-(piperidin-4-ylamino)thiophene-2-carboxamide.
What is the SMILES notation for 3-amino-4-cyclopropyl-N-ethyl-5-(piperidin-4-ylamino)thiophene-2-carboxamide?
The canonical SMILES for 3-amino-4-cyclopropyl-N-ethyl-5-(piperidin-4-ylamino)thiophene-2-carboxamide is CCNC(=O)c1sc(NC2CCNCC2)c(C2CC2)c1N.
What is the InChIKey of 3-amino-4-cyclopropyl-N-ethyl-5-(piperidin-4-ylamino)thiophene-2-carboxamide?
The InChIKey is DERWZGZSRWJBEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4OS/c1-2-18-14(20)13-12(16)11(9-3-4-9)15(21-13)19-10-5-7-17-8-6-10/h9-10,17,19H,2-8,16H2,1H3,(H,18,20).
What are the key properties of 3-amino-4-cyclopropyl-N-ethyl-5-(piperidin-4-ylamino)thiophene-2-carboxamide?
3-amino-4-cyclopropyl-N-ethyl-5-(piperidin-4-ylamino)thiophene-2-carboxamide has a molecular weight of 308.45 g/mol, XLogP of 2.12, 5 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-4-cyclopropyl-N-ethyl-5-(piperidin-4-ylamino)thiophene-2-carboxamide is sourced from PubChem (CID 103525554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).