2-[1-(aminomethyl)cyclohexyl]oxy-N-(furan-2-ylmethyl)propanamide

C15H24N2O3 — CID 65050880

IUPAC2-[1-(aminomethyl)cyclohexyl]oxy-N-(furan-2-ylmethyl)propanamide
SMILESCC(OC1(CN)CCCCC1)C(=O)NCc1ccco1
InChIInChI=1S/C15H24N2O3/c1-12(14(18)17-10-13-6-5-9-19-13)20-15(11-16)7-3-2-4-8-15/h5-6,9,12H,2-4,7-8,10-11,16H2,1H3,(H,17,18)
InChIKeyFWHIJWQINYQXAD-UHFFFAOYSA-N
MW280.37 g/mol
LogP1.96
Rot. Bonds6

About 2-[1-(aminomethyl)cyclohexyl]oxy-N-(furan-2-ylmethyl)propanamide

2-[1-(aminomethyl)cyclohexyl]oxy-N-(furan-2-ylmethyl)propanamide (PubChem CID 65050880) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is 2-[1-(aminomethyl)cyclohexyl]oxy-N-(furan-2-ylmethyl)propanamide.

Molecular Properties

Compound Name2-[1-(aminomethyl)cyclohexyl]oxy-N-(furan-2-ylmethyl)propanamide
PubChem CID65050880
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC Name2-[1-(aminomethyl)cyclohexyl]oxy-N-(furan-2-ylmethyl)propanamide
SMILESCC(OC1(CN)CCCCC1)C(=O)NCc1ccco1
InChIInChI=1S/C15H24N2O3/c1-12(14(18)17-10-13-6-5-9-19-13)20-15(11-16)7-3-2-4-8-15/h5-6,9,12H,2-4,7-8,10-11,16H2,1H3,(H,17,18)
InChIKeyFWHIJWQINYQXAD-UHFFFAOYSA-N
XLogP1.96
TPSA77.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[1-(aminomethyl)cycloheptyl]oxy-N-ethylpropanamide
CID 65051480
1-amino-N-(furan-2-ylmethyl)cyclopentane-1-carboxamide
CID 60866496
(2S)-2-[1-(furan-2-ylmethylamino)-1-oxopropan-2-yl]oxypropanoic acid
CID 104876319
N-(furan-2-ylmethyl)-2-[[1-(hydroxymethyl)cyclohexyl]methylamino]propanamide
CID 103966369
1-(furan-2-ylmethyl)-3-propan-2-ylurea
CID 819269
(2R)-N-(furan-2-ylmethyl)-2-hydroxypropanamide
CID 93242884
2-[[1-(dimethylamino)cyclopentyl]methylamino]-N-(furan-2-ylmethyl)propanamide
CID 78915193
2-[2-(2-aminophenyl)ethoxy]-N-(furan-2-ylmethyl)propanamide
CID 102902392
N-(furan-2-ylmethyl)-2-[(6-methylmorpholin-2-yl)methoxy]propanamide
CID 102633959
N-(furan-2-ylmethyl)acetamide
CID 2394850
methyl 2-(furan-2-ylmethylcarbamoylamino)propanoate
CID 4265713
2-(2-aminoethylamino)-N-(furan-2-ylmethyl)propanamide
CID 62139964

Frequently Asked Questions

What is the IUPAC name of 2-[1-(aminomethyl)cyclohexyl]oxy-N-(furan-2-ylmethyl)propanamide?
The IUPAC name of 2-[1-(aminomethyl)cyclohexyl]oxy-N-(furan-2-ylmethyl)propanamide (CID 65050880) is 2-[1-(aminomethyl)cyclohexyl]oxy-N-(furan-2-ylmethyl)propanamide.
What is the SMILES notation for 2-[1-(aminomethyl)cyclohexyl]oxy-N-(furan-2-ylmethyl)propanamide?
The canonical SMILES for 2-[1-(aminomethyl)cyclohexyl]oxy-N-(furan-2-ylmethyl)propanamide is CC(OC1(CN)CCCCC1)C(=O)NCc1ccco1.
What is the InChIKey of 2-[1-(aminomethyl)cyclohexyl]oxy-N-(furan-2-ylmethyl)propanamide?
The InChIKey is FWHIJWQINYQXAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-12(14(18)17-10-13-6-5-9-19-13)20-15(11-16)7-3-2-4-8-15/h5-6,9,12H,2-4,7-8,10-11,16H2,1H3,(H,17,18).
What are the key properties of 2-[1-(aminomethyl)cyclohexyl]oxy-N-(furan-2-ylmethyl)propanamide?
2-[1-(aminomethyl)cyclohexyl]oxy-N-(furan-2-ylmethyl)propanamide has a molecular weight of 280.37 g/mol, XLogP of 1.96, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(aminomethyl)cyclohexyl]oxy-N-(furan-2-ylmethyl)propanamide is sourced from PubChem (CID 65050880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).