N-cycloheptyl-N'-[1-(furan-2-yl)propan-2-yl]oxamide

C16H24N2O3 — CID 121084182

IUPACN-cycloheptyl-N'-[1-(furan-2-yl)propan-2-yl]oxamide
SMILESCC(Cc1ccco1)NC(=O)C(=O)NC1CCCCCC1
InChIInChI=1S/C16H24N2O3/c1-12(11-14-9-6-10-21-14)17-15(19)16(20)18-13-7-4-2-3-5-8-13/h6,9-10,12-13H,2-5,7-8,11H2,1H3,(H,17,19)(H,18,20)
InChIKeyHDBBXVLIFXXJKC-UHFFFAOYSA-N
MW292.38 g/mol
LogP2.17
Rot. Bonds4

About N-cycloheptyl-N'-[1-(furan-2-yl)propan-2-yl]oxamide

N-cycloheptyl-N'-[1-(furan-2-yl)propan-2-yl]oxamide (PubChem CID 121084182) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-cycloheptyl-N'-[1-(furan-2-yl)propan-2-yl]oxamide.

Molecular Properties

Compound NameN-cycloheptyl-N'-[1-(furan-2-yl)propan-2-yl]oxamide
PubChem CID121084182
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC NameN-cycloheptyl-N'-[1-(furan-2-yl)propan-2-yl]oxamide
SMILESCC(Cc1ccco1)NC(=O)C(=O)NC1CCCCCC1
InChIInChI=1S/C16H24N2O3/c1-12(11-14-9-6-10-21-14)17-15(19)16(20)18-13-7-4-2-3-5-8-13/h6,9-10,12-13H,2-5,7-8,11H2,1H3,(H,17,19)(H,18,20)
InChIKeyHDBBXVLIFXXJKC-UHFFFAOYSA-N
XLogP2.17
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N'-tert-butyl-N-[1-(furan-2-yl)propan-2-yl]oxamide
CID 121084172
(3R)-3-acetamido-N-[(2S)-1-(furan-2-yl)propan-2-yl]piperidine-1-carboxamide
CID 97087871
3-acetamido-N-[1-(furan-2-yl)propan-2-yl]piperidine-1-carboxamide
CID 71893038
N-cyclopentyl-2-(furan-2-yl)acetamide
CID 110690587
N-(1-cyclopentylethyl)-1-(furan-2-yl)propan-2-amine
CID 62634085
N-cyclopentyl-N'-(4-phenylbutan-2-yl)oxamide
CID 18588529
N'-[1-(furan-2-yl)propan-2-yl]-N-(2-methylphenyl)oxamide
CID 121084178
N-[1-(furan-2-yl)propan-2-yl]-4-methylcycloheptan-1-amine
CID 65081351
1-[1-(furan-2-yl)propan-2-ylcarbamoyl]cyclopropane-1-carboxylic acid
CID 62096088
(E)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-methylpent-2-enamide
CID 98205277
N-[(2R)-1-(furan-2-yl)propan-2-yl]-4-(methanesulfonamido)piperidine-1-carboxamide
CID 95383461
N-[1-(furan-2-yl)propan-2-yl]-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide
CID 43705208

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-N'-[1-(furan-2-yl)propan-2-yl]oxamide?
The IUPAC name of N-cycloheptyl-N'-[1-(furan-2-yl)propan-2-yl]oxamide (CID 121084182) is N-cycloheptyl-N'-[1-(furan-2-yl)propan-2-yl]oxamide.
What is the SMILES notation for N-cycloheptyl-N'-[1-(furan-2-yl)propan-2-yl]oxamide?
The canonical SMILES for N-cycloheptyl-N'-[1-(furan-2-yl)propan-2-yl]oxamide is CC(Cc1ccco1)NC(=O)C(=O)NC1CCCCCC1.
What is the InChIKey of N-cycloheptyl-N'-[1-(furan-2-yl)propan-2-yl]oxamide?
The InChIKey is HDBBXVLIFXXJKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-12(11-14-9-6-10-21-14)17-15(19)16(20)18-13-7-4-2-3-5-8-13/h6,9-10,12-13H,2-5,7-8,11H2,1H3,(H,17,19)(H,18,20).
What are the key properties of N-cycloheptyl-N'-[1-(furan-2-yl)propan-2-yl]oxamide?
N-cycloheptyl-N'-[1-(furan-2-yl)propan-2-yl]oxamide has a molecular weight of 292.38 g/mol, XLogP of 2.17, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-N'-[1-(furan-2-yl)propan-2-yl]oxamide is sourced from PubChem (CID 121084182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).