2,4,5-trimethyl-N-(3-morpholin-4-ylpropyl)furan-3-carboxamide

C15H24N2O3 — CID 47136432

IUPAC2,4,5-trimethyl-N-(3-morpholin-4-ylpropyl)furan-3-carboxamide
SMILESCc1oc(C)c(C(=O)NCCCN2CCOCC2)c1C
InChIInChI=1S/C15H24N2O3/c1-11-12(2)20-13(3)14(11)15(18)16-5-4-6-17-7-9-19-10-8-17/h4-10H2,1-3H3,(H,16,18)
InChIKeyVEHYCLOTTDPAON-UHFFFAOYSA-N
MW280.37 g/mol
LogP1.66
Rot. Bonds5

About 2,4,5-trimethyl-N-(3-morpholin-4-ylpropyl)furan-3-carboxamide

2,4,5-trimethyl-N-(3-morpholin-4-ylpropyl)furan-3-carboxamide (PubChem CID 47136432) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is 2,4,5-trimethyl-N-(3-morpholin-4-ylpropyl)furan-3-carboxamide.

Molecular Properties

Compound Name2,4,5-trimethyl-N-(3-morpholin-4-ylpropyl)furan-3-carboxamide
PubChem CID47136432
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC Name2,4,5-trimethyl-N-(3-morpholin-4-ylpropyl)furan-3-carboxamide
SMILESCc1oc(C)c(C(=O)NCCCN2CCOCC2)c1C
InChIInChI=1S/C15H24N2O3/c1-11-12(2)20-13(3)14(11)15(18)16-5-4-6-17-7-9-19-10-8-17/h4-10H2,1-3H3,(H,16,18)
InChIKeyVEHYCLOTTDPAON-UHFFFAOYSA-N
XLogP1.66
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N,N'-bis(3-morpholin-4-ylpropyl)propanediamide
CID 21205309
1-N,4-N-bis(3-morpholin-4-ylpropyl)benzene-1,4-dicarboxamide;hydrochloride
CID 54609927
3,6-dimethyl-N-(4-morpholin-4-ylbutyl)-4-oxofuro[2,3-d]pyrimidine-5-carboxamide
CID 55849068
5-chloro-3-methyl-N-(3-morpholin-4-ylpropyl)-1-phenylpyrazole-4-carboxamide
CID 51155914
[3,5-dimethoxy-4-(3-morpholin-4-ylpropylcarbamoyl)phenyl]carbamic acid
CID 121255435
4-(chloromethyl)-N-(3-morpholin-4-ylpropyl)benzamide
CID 43168028
4-chloro-1,5-dimethyl-N-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide
CID 19266741
4-methyl-N-(3-morpholin-4-ylpropyl)thiadiazole-5-carboxamide
CID 7576732
2-methyl-5-methylsulfonyl-N-(3-morpholin-4-ylpropyl)benzamide
CID 55342252
methyl 2-ethyl-4-methyl-5-(3-morpholin-4-ylpropylcarbamoyl)-1H-pyrrole-3-carboxylate
CID 35070861
4-(methylamino)-N-(3-morpholin-4-ylpropyl)benzamide
CID 62167538
N-(3-morpholin-4-ylpropyl)-5-morpholin-4-ylsulfonylfuran-2-carboxamide
CID 35993608

Frequently Asked Questions

What is the IUPAC name of 2,4,5-trimethyl-N-(3-morpholin-4-ylpropyl)furan-3-carboxamide?
The IUPAC name of 2,4,5-trimethyl-N-(3-morpholin-4-ylpropyl)furan-3-carboxamide (CID 47136432) is 2,4,5-trimethyl-N-(3-morpholin-4-ylpropyl)furan-3-carboxamide.
What is the SMILES notation for 2,4,5-trimethyl-N-(3-morpholin-4-ylpropyl)furan-3-carboxamide?
The canonical SMILES for 2,4,5-trimethyl-N-(3-morpholin-4-ylpropyl)furan-3-carboxamide is Cc1oc(C)c(C(=O)NCCCN2CCOCC2)c1C.
What is the InChIKey of 2,4,5-trimethyl-N-(3-morpholin-4-ylpropyl)furan-3-carboxamide?
The InChIKey is VEHYCLOTTDPAON-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-11-12(2)20-13(3)14(11)15(18)16-5-4-6-17-7-9-19-10-8-17/h4-10H2,1-3H3,(H,16,18).
What are the key properties of 2,4,5-trimethyl-N-(3-morpholin-4-ylpropyl)furan-3-carboxamide?
2,4,5-trimethyl-N-(3-morpholin-4-ylpropyl)furan-3-carboxamide has a molecular weight of 280.37 g/mol, XLogP of 1.66, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,5-trimethyl-N-(3-morpholin-4-ylpropyl)furan-3-carboxamide is sourced from PubChem (CID 47136432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).