N-[3-(diethylamino)-3-oxopropyl]-N-(2-methylpropyl)furan-3-carboxamide

C16H26N2O3 — CID 4651219

IUPACN-[3-(diethylamino)-3-oxopropyl]-N-(2-methylpropyl)furan-3-carboxamide
SMILESCCN(CC)C(=O)CCN(CC(C)C)C(=O)c1ccoc1
InChIInChI=1S/C16H26N2O3/c1-5-17(6-2)15(19)7-9-18(11-13(3)4)16(20)14-8-10-21-12-14/h8,10,12-13H,5-7,9,11H2,1-4H3
InChIKeyGKQKXNCZSRBFTR-UHFFFAOYSA-N
MW294.39 g/mol
LogP2.64
Rot. Bonds8

About N-[3-(diethylamino)-3-oxopropyl]-N-(2-methylpropyl)furan-3-carboxamide

N-[3-(diethylamino)-3-oxopropyl]-N-(2-methylpropyl)furan-3-carboxamide (PubChem CID 4651219) has the molecular formula C16H26N2O3 and a molecular weight of 294.39 g/mol. Its IUPAC name is N-[3-(diethylamino)-3-oxopropyl]-N-(2-methylpropyl)furan-3-carboxamide.

Molecular Properties

Compound NameN-[3-(diethylamino)-3-oxopropyl]-N-(2-methylpropyl)furan-3-carboxamide
PubChem CID4651219
Molecular FormulaC16H26N2O3
Molecular Weight294.39 g/mol
Exact Mass294.19
IUPAC NameN-[3-(diethylamino)-3-oxopropyl]-N-(2-methylpropyl)furan-3-carboxamide
SMILESCCN(CC)C(=O)CCN(CC(C)C)C(=O)c1ccoc1
InChIInChI=1S/C16H26N2O3/c1-5-17(6-2)15(19)7-9-18(11-13(3)4)16(20)14-8-10-21-12-14/h8,10,12-13H,5-7,9,11H2,1-4H3
InChIKeyGKQKXNCZSRBFTR-UHFFFAOYSA-N
XLogP2.64
TPSA53.76 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.39
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[[(2R)-butan-2-yl]amino]-3-oxopropyl]-N-(2-methylpropyl)furan-3-carboxamide
CID 7330670
N,N-bis(3-methylbutyl)furan-3-carboxamide
CID 78833315
N-[3-(furan-2-ylmethylamino)-3-oxopropyl]-N-(2-methylpropyl)furan-3-carboxamide
CID 4685025
N-[3-(diethylamino)-3-oxopropyl]-2,5-dimethyl-N-(2-methylpropyl)furan-3-carboxamide
CID 3591637
N-[3-(butan-2-ylamino)-3-oxopropyl]-N-pentylfuran-3-carboxamide
CID 4191902
N-(2-aminoethyl)-N-(2,2-difluoroethyl)furan-3-carboxamide
CID 107493245
N-ethyl-N-[3-[(4-fluorophenyl)methylamino]-3-oxopropyl]furan-3-carboxamide
CID 4639434
2-[ethyl-[3-(furan-3-carbonylamino)propanoyl]amino]acetic acid
CID 54901043
N-[(2S)-butan-2-yl]-N-[3-(2-methylpropylamino)-3-oxopropyl]furan-3-carboxamide
CID 7297504
4-[ethyl(2-methylpropyl)carbamoyl]benzoic acid
CID 43452953
N-benzyl-N-[3-(butan-2-ylamino)-3-oxopropyl]furan-3-carboxamide
CID 42780168
N-butan-2-yl-N-butylfuran-3-carboxamide
CID 78858377

Frequently Asked Questions

What is the IUPAC name of N-[3-(diethylamino)-3-oxopropyl]-N-(2-methylpropyl)furan-3-carboxamide?
The IUPAC name of N-[3-(diethylamino)-3-oxopropyl]-N-(2-methylpropyl)furan-3-carboxamide (CID 4651219) is N-[3-(diethylamino)-3-oxopropyl]-N-(2-methylpropyl)furan-3-carboxamide.
What is the SMILES notation for N-[3-(diethylamino)-3-oxopropyl]-N-(2-methylpropyl)furan-3-carboxamide?
The canonical SMILES for N-[3-(diethylamino)-3-oxopropyl]-N-(2-methylpropyl)furan-3-carboxamide is CCN(CC)C(=O)CCN(CC(C)C)C(=O)c1ccoc1.
What is the InChIKey of N-[3-(diethylamino)-3-oxopropyl]-N-(2-methylpropyl)furan-3-carboxamide?
The InChIKey is GKQKXNCZSRBFTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O3/c1-5-17(6-2)15(19)7-9-18(11-13(3)4)16(20)14-8-10-21-12-14/h8,10,12-13H,5-7,9,11H2,1-4H3.
What are the key properties of N-[3-(diethylamino)-3-oxopropyl]-N-(2-methylpropyl)furan-3-carboxamide?
N-[3-(diethylamino)-3-oxopropyl]-N-(2-methylpropyl)furan-3-carboxamide has a molecular weight of 294.39 g/mol, XLogP of 2.64, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(diethylamino)-3-oxopropyl]-N-(2-methylpropyl)furan-3-carboxamide is sourced from PubChem (CID 4651219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).