N-[3-(dipropylamino)-3-oxopropyl]-2-methyl-N-(oxolan-2-ylmethyl)furan-3-carboxamide

C20H32N2O4 — CID 42780309

IUPACN-[3-(dipropylamino)-3-oxopropyl]-2-methyl-N-(oxolan-2-ylmethyl)furan-3-carboxamide
SMILESCCCN(CCC)C(=O)CCN(CC1CCCO1)C(=O)c1ccoc1C
InChIInChI=1S/C20H32N2O4/c1-4-10-21(11-5-2)19(23)8-12-22(15-17-7-6-13-26-17)20(24)18-9-14-25-16(18)3/h9,14,17H,4-8,10-13,15H2,1-3H3
InChIKeyDCDQABXZMBBNNX-UHFFFAOYSA-N
MW364.49 g/mol
LogP3.25
Rot. Bonds10

About N-[3-(dipropylamino)-3-oxopropyl]-2-methyl-N-(oxolan-2-ylmethyl)furan-3-carboxamide

N-[3-(dipropylamino)-3-oxopropyl]-2-methyl-N-(oxolan-2-ylmethyl)furan-3-carboxamide (PubChem CID 42780309) has the molecular formula C20H32N2O4 and a molecular weight of 364.49 g/mol. Its IUPAC name is N-[3-(dipropylamino)-3-oxopropyl]-2-methyl-N-(oxolan-2-ylmethyl)furan-3-carboxamide.

Molecular Properties

Compound NameN-[3-(dipropylamino)-3-oxopropyl]-2-methyl-N-(oxolan-2-ylmethyl)furan-3-carboxamide
PubChem CID42780309
Molecular FormulaC20H32N2O4
Molecular Weight364.49 g/mol
Exact Mass364.24
IUPAC NameN-[3-(dipropylamino)-3-oxopropyl]-2-methyl-N-(oxolan-2-ylmethyl)furan-3-carboxamide
SMILESCCCN(CCC)C(=O)CCN(CC1CCCO1)C(=O)c1ccoc1C
InChIInChI=1S/C20H32N2O4/c1-4-10-21(11-5-2)19(23)8-12-22(15-17-7-6-13-26-17)20(24)18-9-14-25-16(18)3/h9,14,17H,4-8,10-13,15H2,1-3H3
InChIKeyDCDQABXZMBBNNX-UHFFFAOYSA-N
XLogP3.25
TPSA62.99 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.49
LogP ≤ 53.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-3-oxopropyl]-2-methyl-N-[[(2S)-oxolan-2-yl]methyl]furan-3-carboxamide
CID 6548334
N-[3-(dipropylamino)-3-oxopropyl]-5-methyl-N-[[(2R)-oxolan-2-yl]methyl]pyrazine-2-carboxamide
CID 7349690
N-[(1-cyclopentylpiperidin-4-yl)methyl]-2-methyl-N-[[(2R)-oxolan-2-yl]methyl]furan-3-carboxamide
CID 42094625
3-[(2-methylbenzoyl)-(oxolan-2-ylmethyl)amino]propanoic acid
CID 82324599
2-bromo-N,N-bis(oxolan-2-ylmethyl)furan-3-carboxamide
CID 106853558
2-[acetyl(propyl)amino]-N-(furan-2-ylmethyl)-N-[[(2R)-oxolan-2-yl]methyl]acetamide
CID 7271437
3-[(2,5-dimethylfuran-3-carbonyl)-(oxolan-2-ylmethyl)amino]propanoic acid
CID 4104784
N-[2-[furan-2-ylmethyl-[[(2S)-oxolan-2-yl]methyl]amino]-2-oxoethyl]-3-phenyl-N-propylpropanamide
CID 7416321
N-[2-[furan-2-ylmethyl-[[(2R)-oxolan-2-yl]methyl]amino]-2-oxoethyl]-3-phenyl-N-propylpropanamide
CID 7416323
N-butyl-N-[2-[furan-2-ylmethyl-[[(2S)-oxolan-2-yl]methyl]amino]-2-oxoethyl]pentanamide
CID 93110010
3-[butanoyl(oxolan-2-ylmethyl)amino]propanoic acid
CID 82323382
3-[acetyl(oxolan-2-ylmethyl)amino]-N,N-diethylpropanamide
CID 113117319

Frequently Asked Questions

What is the IUPAC name of N-[3-(dipropylamino)-3-oxopropyl]-2-methyl-N-(oxolan-2-ylmethyl)furan-3-carboxamide?
The IUPAC name of N-[3-(dipropylamino)-3-oxopropyl]-2-methyl-N-(oxolan-2-ylmethyl)furan-3-carboxamide (CID 42780309) is N-[3-(dipropylamino)-3-oxopropyl]-2-methyl-N-(oxolan-2-ylmethyl)furan-3-carboxamide.
What is the SMILES notation for N-[3-(dipropylamino)-3-oxopropyl]-2-methyl-N-(oxolan-2-ylmethyl)furan-3-carboxamide?
The canonical SMILES for N-[3-(dipropylamino)-3-oxopropyl]-2-methyl-N-(oxolan-2-ylmethyl)furan-3-carboxamide is CCCN(CCC)C(=O)CCN(CC1CCCO1)C(=O)c1ccoc1C.
What is the InChIKey of N-[3-(dipropylamino)-3-oxopropyl]-2-methyl-N-(oxolan-2-ylmethyl)furan-3-carboxamide?
The InChIKey is DCDQABXZMBBNNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32N2O4/c1-4-10-21(11-5-2)19(23)8-12-22(15-17-7-6-13-26-17)20(24)18-9-14-25-16(18)3/h9,14,17H,4-8,10-13,15H2,1-3H3.
What are the key properties of N-[3-(dipropylamino)-3-oxopropyl]-2-methyl-N-(oxolan-2-ylmethyl)furan-3-carboxamide?
N-[3-(dipropylamino)-3-oxopropyl]-2-methyl-N-(oxolan-2-ylmethyl)furan-3-carboxamide has a molecular weight of 364.49 g/mol, XLogP of 3.25, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dipropylamino)-3-oxopropyl]-2-methyl-N-(oxolan-2-ylmethyl)furan-3-carboxamide is sourced from PubChem (CID 42780309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).