N-ethyl-2,5-dimethyl-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]furan-3-carboxamide

C19H25N3O3 — CID 3643874

IUPACN-ethyl-2,5-dimethyl-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]furan-3-carboxamide
SMILESCCN(CCC(=O)NCCc1ccccn1)C(=O)c1cc(C)oc1C
InChIInChI=1S/C19H25N3O3/c1-4-22(19(24)17-13-14(2)25-15(17)3)12-9-18(23)21-11-8-16-7-5-6-10-20-16/h5-7,10,13H,4,8-9,11-12H2,1-3H3,(H,21,23)
InChIKeyUQBUJJBWUZYBIP-UHFFFAOYSA-N
MW343.43 g/mol
LogP2.50
Rot. Bonds8

About N-ethyl-2,5-dimethyl-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]furan-3-carboxamide

N-ethyl-2,5-dimethyl-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]furan-3-carboxamide (PubChem CID 3643874) has the molecular formula C19H25N3O3 and a molecular weight of 343.43 g/mol. Its IUPAC name is N-ethyl-2,5-dimethyl-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]furan-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-2,5-dimethyl-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]furan-3-carboxamide
PubChem CID3643874
Molecular FormulaC19H25N3O3
Molecular Weight343.43 g/mol
Exact Mass343.19
IUPAC NameN-ethyl-2,5-dimethyl-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]furan-3-carboxamide
SMILESCCN(CCC(=O)NCCc1ccccn1)C(=O)c1cc(C)oc1C
InChIInChI=1S/C19H25N3O3/c1-4-22(19(24)17-13-14(2)25-15(17)3)12-9-18(23)21-11-8-16-7-5-6-10-20-16/h5-7,10,13H,4,8-9,11-12H2,1-3H3,(H,21,23)
InChIKeyUQBUJJBWUZYBIP-UHFFFAOYSA-N
XLogP2.50
TPSA75.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-2,5-dimethyl-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]furan-3-carboxamide
CID 3695173
N-[3-(diethylamino)-3-oxopropyl]-N-ethyl-2,5-dimethylfuran-3-carboxamide
CID 3303521
1,1-diethyl-3-(2-pyridin-2-ylethyl)urea
CID 115583070
N-(furan-2-ylmethyl)-2,5-dimethyl-N-[3-oxo-3-(2-phenylethylamino)propyl]furan-3-carboxamide
CID 5071057
N-[3-(benzylamino)-3-oxopropyl]-2,5-dimethyl-N-propylfuran-3-carboxamide
CID 42779701
N-[3-[2-(dimethylamino)ethylamino]-3-oxopropyl]-2,5-dimethyl-N-pentylfuran-3-carboxamide
CID 42780086
5-(4-methylphenyl)-N-(2-methylpropyl)-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]-1,2-oxazole-3-carboxamide
CID 51070099
N-(3-methylbutyl)-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]furan-3-carboxamide
CID 4192735
N-(3-methylbutyl)-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]pyrazine-2-carboxamide
CID 42783152
N-(2-methoxyethyl)-5-methyl-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]pyrazine-2-carboxamide
CID 5186435
3-(2-ethoxyphenyl)-N-(2-pyridin-2-ylethyl)propanamide
CID 78805128
N-benzyl-N-[3-(butan-2-ylamino)-3-oxopropyl]-2,5-dimethylfuran-3-carboxamide
CID 42780264

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,5-dimethyl-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]furan-3-carboxamide?
The IUPAC name of N-ethyl-2,5-dimethyl-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]furan-3-carboxamide (CID 3643874) is N-ethyl-2,5-dimethyl-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]furan-3-carboxamide.
What is the SMILES notation for N-ethyl-2,5-dimethyl-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]furan-3-carboxamide?
The canonical SMILES for N-ethyl-2,5-dimethyl-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]furan-3-carboxamide is CCN(CCC(=O)NCCc1ccccn1)C(=O)c1cc(C)oc1C.
What is the InChIKey of N-ethyl-2,5-dimethyl-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]furan-3-carboxamide?
The InChIKey is UQBUJJBWUZYBIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O3/c1-4-22(19(24)17-13-14(2)25-15(17)3)12-9-18(23)21-11-8-16-7-5-6-10-20-16/h5-7,10,13H,4,8-9,11-12H2,1-3H3,(H,21,23).
What are the key properties of N-ethyl-2,5-dimethyl-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]furan-3-carboxamide?
N-ethyl-2,5-dimethyl-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]furan-3-carboxamide has a molecular weight of 343.43 g/mol, XLogP of 2.50, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,5-dimethyl-N-[3-oxo-3-(2-pyridin-2-ylethylamino)propyl]furan-3-carboxamide is sourced from PubChem (CID 3643874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).