N-cyclooctylfuran-2-carboxamide

C13H19NO2 — CID 790432

IUPACN-cyclooctylfuran-2-carboxamide
SMILESO=C(NC1CCCCCCC1)c1ccco1
InChIInChI=1S/C13H19NO2/c15-13(12-9-6-10-16-12)14-11-7-4-2-1-3-5-8-11/h6,9-11H,1-5,7-8H2,(H,14,15)
InChIKeyIPJRKZXWEJJHPH-UHFFFAOYSA-N
MW221.30 g/mol
LogP3.12
Rot. Bonds2

About N-cyclooctylfuran-2-carboxamide

N-cyclooctylfuran-2-carboxamide (PubChem CID 790432) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is N-cyclooctylfuran-2-carboxamide.

Molecular Properties

Compound NameN-cyclooctylfuran-2-carboxamide
PubChem CID790432
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC NameN-cyclooctylfuran-2-carboxamide
SMILESO=C(NC1CCCCCCC1)c1ccco1
InChIInChI=1S/C13H19NO2/c15-13(12-9-6-10-16-12)14-11-7-4-2-1-3-5-8-11/h6,9-11H,1-5,7-8H2,(H,14,15)
InChIKeyIPJRKZXWEJJHPH-UHFFFAOYSA-N
XLogP3.12
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-methylcycloheptyl)furan-2-carboxamide
CID 102795196
N-(4-bromocyclohexyl)furan-2-carboxamide
CID 114309141
N-[(1R,2R)-2-hydroxycyclohexyl]furan-2-carboxamide
CID 27126578
N-[4-(2-hydroxyethyl)cyclohexyl]furan-2-carboxamide
CID 115270358
N-(3-aminocyclobutyl)furan-2-carboxamide
CID 43594882
N-(1,1-dioxothietan-3-yl)furan-2-carboxamide
CID 130935311
N-(thiolan-3-yl)furan-2-carboxamide
CID 103708637
N-[[4-(cycloheptylamino)-4-oxobutan-2-ylidene]amino]furan-2-carboxamide
CID 4307620
N-(3,5-dimethylcyclohexyl)furan-2-carboxamide
CID 64722741
N-[2-[[(cyclohexylamino)-(ethylamino)methylidene]amino]ethyl]furan-2-carboxamide
CID 110958203
N-[(1R,2S)-2-tert-butylcyclohexyl]furan-2-carboxamide
CID 27451326
N-cyclopentyl-4-(furan-2-yl)-4-oxobutanamide
CID 110389813

Frequently Asked Questions

What is the IUPAC name of N-cyclooctylfuran-2-carboxamide?
The IUPAC name of N-cyclooctylfuran-2-carboxamide (CID 790432) is N-cyclooctylfuran-2-carboxamide.
What is the SMILES notation for N-cyclooctylfuran-2-carboxamide?
The canonical SMILES for N-cyclooctylfuran-2-carboxamide is O=C(NC1CCCCCCC1)c1ccco1.
What is the InChIKey of N-cyclooctylfuran-2-carboxamide?
The InChIKey is IPJRKZXWEJJHPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c15-13(12-9-6-10-16-12)14-11-7-4-2-1-3-5-8-11/h6,9-11H,1-5,7-8H2,(H,14,15).
What are the key properties of N-cyclooctylfuran-2-carboxamide?
N-cyclooctylfuran-2-carboxamide has a molecular weight of 221.30 g/mol, XLogP of 3.12, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclooctylfuran-2-carboxamide is sourced from PubChem (CID 790432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).