2-[(4-ethylcyclohexyl)amino]-N-(furan-2-ylmethyl)propanamide

C16H26N2O2 — CID 61469898

IUPAC2-[(4-ethylcyclohexyl)amino]-N-(furan-2-ylmethyl)propanamide
SMILESCCC1CCC(NC(C)C(=O)NCc2ccco2)CC1
InChIInChI=1S/C16H26N2O2/c1-3-13-6-8-14(9-7-13)18-12(2)16(19)17-11-15-5-4-10-20-15/h4-5,10,12-14,18H,3,6-9,11H2,1-2H3,(H,17,19)
InChIKeyLVZVDBGRMVMYCZ-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.84
Rot. Bonds6

About 2-[(4-ethylcyclohexyl)amino]-N-(furan-2-ylmethyl)propanamide

2-[(4-ethylcyclohexyl)amino]-N-(furan-2-ylmethyl)propanamide (PubChem CID 61469898) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 2-[(4-ethylcyclohexyl)amino]-N-(furan-2-ylmethyl)propanamide.

Molecular Properties

Compound Name2-[(4-ethylcyclohexyl)amino]-N-(furan-2-ylmethyl)propanamide
PubChem CID61469898
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC Name2-[(4-ethylcyclohexyl)amino]-N-(furan-2-ylmethyl)propanamide
SMILESCCC1CCC(NC(C)C(=O)NCc2ccco2)CC1
InChIInChI=1S/C16H26N2O2/c1-3-13-6-8-14(9-7-13)18-12(2)16(19)17-11-15-5-4-10-20-15/h4-5,10,12-14,18H,3,6-9,11H2,1-2H3,(H,17,19)
InChIKeyLVZVDBGRMVMYCZ-UHFFFAOYSA-N
XLogP2.84
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclopropylamino)-N-(furan-2-ylmethyl)propanamide
CID 43084580
2-(cyclobutylamino)-N-(furan-2-ylmethyl)propanamide
CID 62414574
2-(cyclopent-3-en-1-ylamino)-N-(furan-2-ylmethyl)propanamide
CID 113475228
N-(furan-2-ylmethyl)-2-(oxolan-3-ylamino)propanamide
CID 80712559
2-[[2-(cyclopropylamino)-2-oxoethyl]amino]-N-(furan-2-ylmethyl)propanamide
CID 43401424
tert-butyl N-[3-[[(2S)-1-(furan-2-ylmethylamino)-1-oxopropan-2-yl]amino]cyclobutyl]carbamate
CID 100662508
N-[(2R)-1-(furan-2-ylmethylamino)-1-oxopropan-2-yl]cyclohexanecarboxamide
CID 94216559
(2R)-N-(furan-2-ylmethyl)-2-hydroxypropanamide
CID 93242884
N-(furan-2-ylmethyl)-2-(methoxyamino)propanamide
CID 60702583
N-[2-[[1-(furan-2-ylmethylamino)-1-oxopropan-2-yl]amino]ethyl]cyclopropanecarboxamide
CID 115574214
4-ethyl-N-[4-(furan-2-yl)butan-2-yl]cycloheptan-1-amine
CID 65082213
4-ethyl-1-(furan-2-ylmethylcarbamoylamino)cyclohexane-1-carboxylic acid
CID 61188086

Frequently Asked Questions

What is the IUPAC name of 2-[(4-ethylcyclohexyl)amino]-N-(furan-2-ylmethyl)propanamide?
The IUPAC name of 2-[(4-ethylcyclohexyl)amino]-N-(furan-2-ylmethyl)propanamide (CID 61469898) is 2-[(4-ethylcyclohexyl)amino]-N-(furan-2-ylmethyl)propanamide.
What is the SMILES notation for 2-[(4-ethylcyclohexyl)amino]-N-(furan-2-ylmethyl)propanamide?
The canonical SMILES for 2-[(4-ethylcyclohexyl)amino]-N-(furan-2-ylmethyl)propanamide is CCC1CCC(NC(C)C(=O)NCc2ccco2)CC1.
What is the InChIKey of 2-[(4-ethylcyclohexyl)amino]-N-(furan-2-ylmethyl)propanamide?
The InChIKey is LVZVDBGRMVMYCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-3-13-6-8-14(9-7-13)18-12(2)16(19)17-11-15-5-4-10-20-15/h4-5,10,12-14,18H,3,6-9,11H2,1-2H3,(H,17,19).
What are the key properties of 2-[(4-ethylcyclohexyl)amino]-N-(furan-2-ylmethyl)propanamide?
2-[(4-ethylcyclohexyl)amino]-N-(furan-2-ylmethyl)propanamide has a molecular weight of 278.40 g/mol, XLogP of 2.84, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-ethylcyclohexyl)amino]-N-(furan-2-ylmethyl)propanamide is sourced from PubChem (CID 61469898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).