N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide

C19H18N2O4 — CID 86851788

IUPACN-[4-(2,6-dioxopiperidin-1-yl)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide
SMILESO=C(Nc1ccc(N2C(=O)CCCC2=O)cc1)C1CC1c1ccco1
InChIInChI=1S/C19H18N2O4/c22-17-4-1-5-18(23)21(17)13-8-6-12(7-9-13)20-19(24)15-11-14(15)16-3-2-10-25-16/h2-3,6-10,14-15H,1,4-5,11H2,(H,20,24)
InChIKeyIMIHWKIMVJBGOK-UHFFFAOYSA-N
MW338.36 g/mol
LogP3.07
Rot. Bonds4

About N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide

N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide (PubChem CID 86851788) has the molecular formula C19H18N2O4 and a molecular weight of 338.36 g/mol. Its IUPAC name is N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-[4-(2,6-dioxopiperidin-1-yl)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide
PubChem CID86851788
Molecular FormulaC19H18N2O4
Molecular Weight338.36 g/mol
Exact Mass338.13
IUPAC NameN-[4-(2,6-dioxopiperidin-1-yl)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide
SMILESO=C(Nc1ccc(N2C(=O)CCCC2=O)cc1)C1CC1c1ccco1
InChIInChI=1S/C19H18N2O4/c22-17-4-1-5-18(23)21(17)13-8-6-12(7-9-13)20-19(24)15-11-14(15)16-3-2-10-25-16/h2-3,6-10,14-15H,1,4-5,11H2,(H,20,24)
InChIKeyIMIHWKIMVJBGOK-UHFFFAOYSA-N
XLogP3.07
TPSA79.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.36
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

ethyl N-[4-[[2-(furan-2-yl)cyclopropanecarbonyl]amino]phenyl]carbamate
CID 86851812
2-(furan-2-yl)-N-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)cyclopropane-1-carboxamide
CID 86852022
trans-(1S,2S)-2-(furan-2-yl)-N-(4-morpholin-4-ylsulfonylphenyl)cyclopropane-1-carboxamide
CID 52518250
2-(furan-2-yl)-N-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]cyclopropane-1-carboxamide
CID 71936659
cis-(1S,2R)-2-(furan-2-yl)-N-(4-morpholin-4-ylsulfonylphenyl)cyclopropane-1-carboxamide
CID 52518249
2-(furan-2-yl)-N-[[3-(2-oxopyrrolidin-1-yl)phenyl]methyl]cyclopropane-1-carboxamide
CID 75526323
N-(3-acetamido-4-methylphenyl)-2-(furan-2-yl)cyclopropane-1-carboxamide
CID 86851825
trans-(1R,2R)-N-[3-(1,3-dithian-2-yl)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide
CID 97204291
cis-(1S,2R)-2-(furan-2-yl)-N-[[3-(2-oxopiperidin-1-yl)phenyl]methyl]cyclopropane-1-carboxamide
CID 97011479
5-[[(1R,2R)-2-(furan-2-yl)cyclopropanecarbonyl]amino]-1-N,3-N-dimethylbenzene-1,3-dicarboxamide
CID 166375052
(2R)-N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-2,3-dihydro-1-benzofuran-2-carboxamide
CID 94801265
N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide
CID 75405611

Frequently Asked Questions

What is the IUPAC name of N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide?
The IUPAC name of N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide (CID 86851788) is N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide.
What is the SMILES notation for N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide?
The canonical SMILES for N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide is O=C(Nc1ccc(N2C(=O)CCCC2=O)cc1)C1CC1c1ccco1.
What is the InChIKey of N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide?
The InChIKey is IMIHWKIMVJBGOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O4/c22-17-4-1-5-18(23)21(17)13-8-6-12(7-9-13)20-19(24)15-11-14(15)16-3-2-10-25-16/h2-3,6-10,14-15H,1,4-5,11H2,(H,20,24).
What are the key properties of N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide?
N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide has a molecular weight of 338.36 g/mol, XLogP of 3.07, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2,6-dioxopiperidin-1-yl)phenyl]-2-(furan-2-yl)cyclopropane-1-carboxamide is sourced from PubChem (CID 86851788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).