N-[3-(benzhydrylamino)-3-oxopropyl]-N-propan-2-ylfuran-3-carboxamide

C24H26N2O3 — CID 42779595

IUPACN-[3-(benzhydrylamino)-3-oxopropyl]-N-propan-2-ylfuran-3-carboxamide
SMILESCC(C)N(CCC(=O)NC(c1ccccc1)c1ccccc1)C(=O)c1ccoc1
InChIInChI=1S/C24H26N2O3/c1-18(2)26(24(28)21-14-16-29-17-21)15-13-22(27)25-23(19-9-5-3-6-10-19)20-11-7-4-8-12-20/h3-12,14,16-18,23H,13,15H2,1-2H3,(H,25,27)
InChIKeyJVUKAQIVSPHEPL-UHFFFAOYSA-N
MW390.48 g/mol
LogP4.43
Rot. Bonds8

About N-[3-(benzhydrylamino)-3-oxopropyl]-N-propan-2-ylfuran-3-carboxamide

N-[3-(benzhydrylamino)-3-oxopropyl]-N-propan-2-ylfuran-3-carboxamide (PubChem CID 42779595) has the molecular formula C24H26N2O3 and a molecular weight of 390.48 g/mol. Its IUPAC name is N-[3-(benzhydrylamino)-3-oxopropyl]-N-propan-2-ylfuran-3-carboxamide.

Molecular Properties

Compound NameN-[3-(benzhydrylamino)-3-oxopropyl]-N-propan-2-ylfuran-3-carboxamide
PubChem CID42779595
Molecular FormulaC24H26N2O3
Molecular Weight390.48 g/mol
Exact Mass390.19
IUPAC NameN-[3-(benzhydrylamino)-3-oxopropyl]-N-propan-2-ylfuran-3-carboxamide
SMILESCC(C)N(CCC(=O)NC(c1ccccc1)c1ccccc1)C(=O)c1ccoc1
InChIInChI=1S/C24H26N2O3/c1-18(2)26(24(28)21-14-16-29-17-21)15-13-22(27)25-23(19-9-5-3-6-10-19)20-11-7-4-8-12-20/h3-12,14,16-18,23H,13,15H2,1-2H3,(H,25,27)
InChIKeyJVUKAQIVSPHEPL-UHFFFAOYSA-N
XLogP4.43
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.48
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-aminoethyl)-N-propan-2-ylfuran-3-carboxamide
CID 61350095
N-[(2S)-butan-2-yl]-N-[3-(2-methylpropylamino)-3-oxopropyl]furan-3-carboxamide
CID 7297504
N-benzyl-N-[3-(butan-2-ylamino)-3-oxopropyl]furan-3-carboxamide
CID 42780168
N-[3-[4-(2-chlorophenyl)piperazin-1-yl]-3-oxopropyl]-N-propan-2-ylfuran-3-carboxamide
CID 1030415
N-benzhydryl-3-[dimethyl(phenyl)silyl]propanamide
CID 23292700
N-(3-anilino-3-oxopropyl)-N-methylfuran-3-carboxamide
CID 144676111
N-[3-[[(2R)-butan-2-yl]amino]-3-oxopropyl]-N-(2-methylpropyl)furan-3-carboxamide
CID 7330670
N-[4-(methylamino)-4-oxobutyl]-N-propan-2-ylbenzamide
CID 91902584
N-[3-(butan-2-ylamino)-3-oxopropyl]-N-pentylfuran-3-carboxamide
CID 4191902
3-[benzoyl(1-phenylethyl)amino]propanoic acid
CID 82324526
3-(benzenesulfonyl)-N-benzhydrylpropanamide
CID 17310061
N-[3-(benzhydrylamino)-3-oxopropyl]-N-benzyl-2-methylfuran-3-carboxamide
CID 42779867

Frequently Asked Questions

What is the IUPAC name of N-[3-(benzhydrylamino)-3-oxopropyl]-N-propan-2-ylfuran-3-carboxamide?
The IUPAC name of N-[3-(benzhydrylamino)-3-oxopropyl]-N-propan-2-ylfuran-3-carboxamide (CID 42779595) is N-[3-(benzhydrylamino)-3-oxopropyl]-N-propan-2-ylfuran-3-carboxamide.
What is the SMILES notation for N-[3-(benzhydrylamino)-3-oxopropyl]-N-propan-2-ylfuran-3-carboxamide?
The canonical SMILES for N-[3-(benzhydrylamino)-3-oxopropyl]-N-propan-2-ylfuran-3-carboxamide is CC(C)N(CCC(=O)NC(c1ccccc1)c1ccccc1)C(=O)c1ccoc1.
What is the InChIKey of N-[3-(benzhydrylamino)-3-oxopropyl]-N-propan-2-ylfuran-3-carboxamide?
The InChIKey is JVUKAQIVSPHEPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O3/c1-18(2)26(24(28)21-14-16-29-17-21)15-13-22(27)25-23(19-9-5-3-6-10-19)20-11-7-4-8-12-20/h3-12,14,16-18,23H,13,15H2,1-2H3,(H,25,27).
What are the key properties of N-[3-(benzhydrylamino)-3-oxopropyl]-N-propan-2-ylfuran-3-carboxamide?
N-[3-(benzhydrylamino)-3-oxopropyl]-N-propan-2-ylfuran-3-carboxamide has a molecular weight of 390.48 g/mol, XLogP of 4.43, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(benzhydrylamino)-3-oxopropyl]-N-propan-2-ylfuran-3-carboxamide is sourced from PubChem (CID 42779595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).