N-[4-[[(2R,4R)-4-(furan-2-yl)-4-hydroxybutan-2-yl]amino]cyclohexyl]acetamide

C16H26N2O3 — CID 99634339

IUPACN-[4-[[(2R,4R)-4-(furan-2-yl)-4-hydroxybutan-2-yl]amino]cyclohexyl]acetamide
SMILESCC(=O)NC1CCC(N[C@H](C)C[C@@H](O)c2ccco2)CC1
InChIInChI=1S/C16H26N2O3/c1-11(10-15(20)16-4-3-9-21-16)17-13-5-7-14(8-6-13)18-12(2)19/h3-4,9,11,13-15,17,20H,5-8,10H2,1-2H3,(H,18,19)/t11-,13?,14?,15-/m1/s1
InChIKeyQGOUDLFUNFHGOU-GALLPEHLSA-N
MW294.39 g/mol
LogP2.13
Rot. Bonds6

About N-[4-[[(2R,4R)-4-(furan-2-yl)-4-hydroxybutan-2-yl]amino]cyclohexyl]acetamide

N-[4-[[(2R,4R)-4-(furan-2-yl)-4-hydroxybutan-2-yl]amino]cyclohexyl]acetamide (PubChem CID 99634339) has the molecular formula C16H26N2O3 and a molecular weight of 294.39 g/mol. Its IUPAC name is N-[4-[[(2R,4R)-4-(furan-2-yl)-4-hydroxybutan-2-yl]amino]cyclohexyl]acetamide.

Molecular Properties

Compound NameN-[4-[[(2R,4R)-4-(furan-2-yl)-4-hydroxybutan-2-yl]amino]cyclohexyl]acetamide
PubChem CID99634339
Molecular FormulaC16H26N2O3
Molecular Weight294.39 g/mol
Exact Mass294.19
IUPAC NameN-[4-[[(2R,4R)-4-(furan-2-yl)-4-hydroxybutan-2-yl]amino]cyclohexyl]acetamide
SMILESCC(=O)NC1CCC(N[C@H](C)C[C@@H](O)c2ccco2)CC1
InChIInChI=1S/C16H26N2O3/c1-11(10-15(20)16-4-3-9-21-16)17-13-5-7-14(8-6-13)18-12(2)19/h3-4,9,11,13-15,17,20H,5-8,10H2,1-2H3,(H,18,19)/t11-,13?,14?,15-/m1/s1
InChIKeyQGOUDLFUNFHGOU-GALLPEHLSA-N
XLogP2.13
TPSA74.50 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.39
LogP ≤ 52.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-[4-[[(2R,4R)-4-(furan-2-yl)-4-hydroxybutan-2-yl]amino]cyclohexyl]acetamide with MolForge

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Related Compounds

(1R,3S)-3-[[3-(2-fluorophenyl)cyclobutyl]amino]-1-(furan-2-yl)butan-1-ol
CID 99621655
(1S,3R)-1-(furan-2-yl)-3-[[(1S,3R)-3-(trifluoromethyl)cyclohexyl]amino]butan-1-ol
CID 129430023
(1S,3S)-1-(furan-2-yl)butane-1,3-diol
CID 46177371
(2S)-N-[(2R,4R)-4-(furan-2-yl)-4-hydroxybutan-2-yl]-2-hydroxy-2-phenylacetamide
CID 99589419
[2-(cyclopropylcarbamoylamino)-2-oxoethyl]-[(1R)-1-(furan-2-yl)ethyl]azanium
CID 8920889
1-[cyclopropyl-(4-fluorophenyl)methyl]-3-[4-(furan-2-yl)-4-hydroxybutan-2-yl]urea
CID 71919597
1-cyclopentyl-N-[(2R,4S)-4-(furan-2-yl)-4-hydroxybutan-2-yl]pyrazole-3-carboxamide
CID 97247623
1-[2-(furan-2-yl)-2-hydroxyethyl]-3-(4-propylcyclohexyl)urea
CID 110904027
5-cyclohexyl-N-[(2S,4R)-4-(furan-2-yl)-4-hydroxybutan-2-yl]-1H-pyrazole-4-carboxamide
CID 99777998
2-amino-N-cyclopropyl-2-(furan-2-yl)acetamide
CID 83529933
(2S)-N-cyclopentyl-2-[[(1S)-1-(furan-2-yl)ethyl]amino]propanamide
CID 93035997
N-[4-[[(2S)-1-(3-methylphenoxy)propan-2-yl]amino]cyclohexyl]acetamide
CID 99632956

Frequently Asked Questions

What is the IUPAC name of N-[4-[[(2R,4R)-4-(furan-2-yl)-4-hydroxybutan-2-yl]amino]cyclohexyl]acetamide?
The IUPAC name of N-[4-[[(2R,4R)-4-(furan-2-yl)-4-hydroxybutan-2-yl]amino]cyclohexyl]acetamide (CID 99634339) is N-[4-[[(2R,4R)-4-(furan-2-yl)-4-hydroxybutan-2-yl]amino]cyclohexyl]acetamide.
What is the SMILES notation for N-[4-[[(2R,4R)-4-(furan-2-yl)-4-hydroxybutan-2-yl]amino]cyclohexyl]acetamide?
The canonical SMILES for N-[4-[[(2R,4R)-4-(furan-2-yl)-4-hydroxybutan-2-yl]amino]cyclohexyl]acetamide is CC(=O)NC1CCC(N[C@H](C)C[C@@H](O)c2ccco2)CC1.
What is the InChIKey of N-[4-[[(2R,4R)-4-(furan-2-yl)-4-hydroxybutan-2-yl]amino]cyclohexyl]acetamide?
The InChIKey is QGOUDLFUNFHGOU-GALLPEHLSA-N. The full InChI is InChI=1S/C16H26N2O3/c1-11(10-15(20)16-4-3-9-21-16)17-13-5-7-14(8-6-13)18-12(2)19/h3-4,9,11,13-15,17,20H,5-8,10H2,1-2H3,(H,18,19)/t11-,13?,14?,15-/m1/s1.
What are the key properties of N-[4-[[(2R,4R)-4-(furan-2-yl)-4-hydroxybutan-2-yl]amino]cyclohexyl]acetamide?
N-[4-[[(2R,4R)-4-(furan-2-yl)-4-hydroxybutan-2-yl]amino]cyclohexyl]acetamide has a molecular weight of 294.39 g/mol, XLogP of 2.13, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[(2R,4R)-4-(furan-2-yl)-4-hydroxybutan-2-yl]amino]cyclohexyl]acetamide is sourced from PubChem (CID 99634339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).