N-methyl-5-morpholin-4-yl-N-[(1-propan-2-ylpiperidin-3-yl)methyl]-4-pyridin-3-ylthiophene-2-carboxamide

C24H34N4O2S — CID 110237381

IUPACN-methyl-5-morpholin-4-yl-N-[(1-propan-2-ylpiperidin-3-yl)methyl]-4-pyridin-3-ylthiophene-2-carboxamide
SMILESCC(C)N1CCCC(CN(C)C(=O)c2cc(-c3cccnc3)c(N3CCOCC3)s2)C1
InChIInChI=1S/C24H34N4O2S/c1-18(2)28-9-5-6-19(17-28)16-26(3)23(29)22-14-21(20-7-4-8-25-15-20)24(31-22)27-10-12-30-13-11-27/h4,7-8,14-15,18-19H,5-6,9-13,16-17H2,1-3H3
InChIKeyFICPGPZADOTDKW-UHFFFAOYSA-N
MW442.63 g/mol
LogP3.84
Rot. Bonds6

About N-methyl-5-morpholin-4-yl-N-[(1-propan-2-ylpiperidin-3-yl)methyl]-4-pyridin-3-ylthiophene-2-carboxamide

N-methyl-5-morpholin-4-yl-N-[(1-propan-2-ylpiperidin-3-yl)methyl]-4-pyridin-3-ylthiophene-2-carboxamide (PubChem CID 110237381) has the molecular formula C24H34N4O2S and a molecular weight of 442.63 g/mol. Its IUPAC name is N-methyl-5-morpholin-4-yl-N-[(1-propan-2-ylpiperidin-3-yl)methyl]-4-pyridin-3-ylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-methyl-5-morpholin-4-yl-N-[(1-propan-2-ylpiperidin-3-yl)methyl]-4-pyridin-3-ylthiophene-2-carboxamide
PubChem CID110237381
Molecular FormulaC24H34N4O2S
Molecular Weight442.63 g/mol
Exact Mass442.24
IUPAC NameN-methyl-5-morpholin-4-yl-N-[(1-propan-2-ylpiperidin-3-yl)methyl]-4-pyridin-3-ylthiophene-2-carboxamide
SMILESCC(C)N1CCCC(CN(C)C(=O)c2cc(-c3cccnc3)c(N3CCOCC3)s2)C1
InChIInChI=1S/C24H34N4O2S/c1-18(2)28-9-5-6-19(17-28)16-26(3)23(29)22-14-21(20-7-4-8-25-15-20)24(31-22)27-10-12-30-13-11-27/h4,7-8,14-15,18-19H,5-6,9-13,16-17H2,1-3H3
InChIKeyFICPGPZADOTDKW-UHFFFAOYSA-N
XLogP3.84
TPSA48.91 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500442.63
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze N-methyl-5-morpholin-4-yl-N-[(1-propan-2-ylpiperidin-3-yl)methyl]-4-pyridin-3-ylthiophene-2-carboxamide with MolForge

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Related Compounds

[(3S)-3-methylpiperidin-1-yl]-(5-morpholin-4-yl-4-pyridin-3-ylthiophen-2-yl)methanone
CID 95856405
N-methyl-5-morpholin-4-yl-N-(1-propan-2-ylpiperidin-4-yl)-4-pyridin-4-ylthiophene-2-carboxamide
CID 46953653
(5-morpholin-4-yl-4-pyridin-3-ylthiophen-2-yl)-phenylmethanone
CID 11842439
methyl 3-methyl-2-[(5-morpholin-4-yl-4-pyridin-3-ylthiophene-2-carbonyl)amino]butanoate
CID 110237373
N-methyl-5-morpholin-4-yl-4-phenyl-N-(2-pyridin-2-ylethyl)thiophene-2-carboxamide
CID 134008677
N-(4-hydroxy-1,1-dioxothiolan-3-yl)-5-morpholin-4-yl-4-pyridin-3-ylthiophene-2-carboxamide
CID 46953657
N-(2-cyanoethyl)-5-morpholin-4-yl-N-(oxan-4-yl)-4-phenylthiophene-2-carboxamide
CID 56572728
[4-(4-methylsulfonylphenyl)-5-morpholin-4-ylthiophen-2-yl]-pyridin-3-ylmethanone
CID 69026448
1-[[(3R)-1-propan-2-ylpiperidin-3-yl]methyl]-3-[(1S)-1-pyridin-3-ylethyl]urea
CID 95598516
1-[(1-propan-2-ylpiperidin-3-yl)methyl]-3-(1-pyridin-3-ylethyl)urea
CID 56827109
5-morpholin-4-yl-N-(1-propan-2-ylpiperidin-4-yl)-4-pyridin-2-ylthiophene-2-carboxamide
CID 46961308
(3,5-dimethylpiperidin-1-yl)-(5-morpholin-4-yl-4-phenylthiophen-2-yl)methanone
CID 24538398

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-morpholin-4-yl-N-[(1-propan-2-ylpiperidin-3-yl)methyl]-4-pyridin-3-ylthiophene-2-carboxamide?
The IUPAC name of N-methyl-5-morpholin-4-yl-N-[(1-propan-2-ylpiperidin-3-yl)methyl]-4-pyridin-3-ylthiophene-2-carboxamide (CID 110237381) is N-methyl-5-morpholin-4-yl-N-[(1-propan-2-ylpiperidin-3-yl)methyl]-4-pyridin-3-ylthiophene-2-carboxamide.
What is the SMILES notation for N-methyl-5-morpholin-4-yl-N-[(1-propan-2-ylpiperidin-3-yl)methyl]-4-pyridin-3-ylthiophene-2-carboxamide?
The canonical SMILES for N-methyl-5-morpholin-4-yl-N-[(1-propan-2-ylpiperidin-3-yl)methyl]-4-pyridin-3-ylthiophene-2-carboxamide is CC(C)N1CCCC(CN(C)C(=O)c2cc(-c3cccnc3)c(N3CCOCC3)s2)C1.
What is the InChIKey of N-methyl-5-morpholin-4-yl-N-[(1-propan-2-ylpiperidin-3-yl)methyl]-4-pyridin-3-ylthiophene-2-carboxamide?
The InChIKey is FICPGPZADOTDKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H34N4O2S/c1-18(2)28-9-5-6-19(17-28)16-26(3)23(29)22-14-21(20-7-4-8-25-15-20)24(31-22)27-10-12-30-13-11-27/h4,7-8,14-15,18-19H,5-6,9-13,16-17H2,1-3H3.
What are the key properties of N-methyl-5-morpholin-4-yl-N-[(1-propan-2-ylpiperidin-3-yl)methyl]-4-pyridin-3-ylthiophene-2-carboxamide?
N-methyl-5-morpholin-4-yl-N-[(1-propan-2-ylpiperidin-3-yl)methyl]-4-pyridin-3-ylthiophene-2-carboxamide has a molecular weight of 442.63 g/mol, XLogP of 3.84, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-morpholin-4-yl-N-[(1-propan-2-ylpiperidin-3-yl)methyl]-4-pyridin-3-ylthiophene-2-carboxamide is sourced from PubChem (CID 110237381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).