4,5-dimethyl-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]thiophene-2-carboxamide

C19H24N2O2S — CID 31445799

IUPAC4,5-dimethyl-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]thiophene-2-carboxamide
SMILESCc1cc(C(=O)NCc2ccc(CN3CCOCC3)cc2)sc1C
InChIInChI=1S/C19H24N2O2S/c1-14-11-18(24-15(14)2)19(22)20-12-16-3-5-17(6-4-16)13-21-7-9-23-10-8-21/h3-6,11H,7-10,12-13H2,1-2H3,(H,20,22)
InChIKeyQLNDEAUIXIUOPW-UHFFFAOYSA-N
MW344.48 g/mol
LogP3.13
Rot. Bonds5

About 4,5-dimethyl-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]thiophene-2-carboxamide

4,5-dimethyl-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]thiophene-2-carboxamide (PubChem CID 31445799) has the molecular formula C19H24N2O2S and a molecular weight of 344.48 g/mol. Its IUPAC name is 4,5-dimethyl-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]thiophene-2-carboxamide.

Molecular Properties

Compound Name4,5-dimethyl-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]thiophene-2-carboxamide
PubChem CID31445799
Molecular FormulaC19H24N2O2S
Molecular Weight344.48 g/mol
Exact Mass344.16
IUPAC Name4,5-dimethyl-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]thiophene-2-carboxamide
SMILESCc1cc(C(=O)NCc2ccc(CN3CCOCC3)cc2)sc1C
InChIInChI=1S/C19H24N2O2S/c1-14-11-18(24-15(14)2)19(22)20-12-16-3-5-17(6-4-16)13-21-7-9-23-10-8-21/h3-6,11H,7-10,12-13H2,1-2H3,(H,20,22)
InChIKeyQLNDEAUIXIUOPW-UHFFFAOYSA-N
XLogP3.13
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.48
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-methyl-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-4-nitrothiophene-2-carboxamide
CID 39643717
3,4-dimethyl-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]benzamide
CID 17397484
N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]thiophene-2-carboxamide
CID 18117454
5-amino-2-methyl-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]benzamide
CID 120640346
3-methyl-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-1-phenylthieno[3,2-d]pyrazole-5-carboxamide
CID 24549522
3-acetamido-4-methyl-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]benzamide
CID 78876482
N-benzyl-4-(morpholin-4-ylmethyl)benzamide
CID 786772
5-chloro-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]furan-2-carboxamide
CID 29475175
N-[(4-cyanophenyl)methyl]-4,5-dimethylthiophene-2-carboxamide
CID 60736885
4,5-dimethyl-N-(2-morpholin-4-ylpropyl)thiophene-2-carboxamide
CID 47168421
3,4,5-trimethoxy-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]benzamide
CID 27890450
N-[[3-(chloromethyl)phenyl]methyl]-4,5-dimethylthiophene-2-carboxamide
CID 113272815

Frequently Asked Questions

What is the IUPAC name of 4,5-dimethyl-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]thiophene-2-carboxamide?
The IUPAC name of 4,5-dimethyl-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]thiophene-2-carboxamide (CID 31445799) is 4,5-dimethyl-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]thiophene-2-carboxamide.
What is the SMILES notation for 4,5-dimethyl-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]thiophene-2-carboxamide?
The canonical SMILES for 4,5-dimethyl-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]thiophene-2-carboxamide is Cc1cc(C(=O)NCc2ccc(CN3CCOCC3)cc2)sc1C.
What is the InChIKey of 4,5-dimethyl-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]thiophene-2-carboxamide?
The InChIKey is QLNDEAUIXIUOPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2S/c1-14-11-18(24-15(14)2)19(22)20-12-16-3-5-17(6-4-16)13-21-7-9-23-10-8-21/h3-6,11H,7-10,12-13H2,1-2H3,(H,20,22).
What are the key properties of 4,5-dimethyl-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]thiophene-2-carboxamide?
4,5-dimethyl-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]thiophene-2-carboxamide has a molecular weight of 344.48 g/mol, XLogP of 3.13, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dimethyl-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]thiophene-2-carboxamide is sourced from PubChem (CID 31445799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).