furan-3-yl-[4-[[(2R)-4-(furan-2-yl)butan-2-yl]amino]piperidin-1-yl]methanone

C18H24N2O3 — CID 97229211

IUPACfuran-3-yl-[4-[[(2R)-4-(furan-2-yl)butan-2-yl]amino]piperidin-1-yl]methanone
SMILESC[C@H](CCc1ccco1)NC1CCN(C(=O)c2ccoc2)CC1
InChIInChI=1S/C18H24N2O3/c1-14(4-5-17-3-2-11-23-17)19-16-6-9-20(10-7-16)18(21)15-8-12-22-13-15/h2-3,8,11-14,16,19H,4-7,9-10H2,1H3/t14-/m1/s1
InChIKeyIWSRMWQSEGVTMT-CQSZACIVSA-N
MW316.40 g/mol
LogP3.09
Rot. Bonds6

About furan-3-yl-[4-[[(2R)-4-(furan-2-yl)butan-2-yl]amino]piperidin-1-yl]methanone

furan-3-yl-[4-[[(2R)-4-(furan-2-yl)butan-2-yl]amino]piperidin-1-yl]methanone (PubChem CID 97229211) has the molecular formula C18H24N2O3 and a molecular weight of 316.40 g/mol. Its IUPAC name is furan-3-yl-[4-[[(2R)-4-(furan-2-yl)butan-2-yl]amino]piperidin-1-yl]methanone.

Molecular Properties

Compound Namefuran-3-yl-[4-[[(2R)-4-(furan-2-yl)butan-2-yl]amino]piperidin-1-yl]methanone
PubChem CID97229211
Molecular FormulaC18H24N2O3
Molecular Weight316.40 g/mol
Exact Mass316.18
IUPAC Namefuran-3-yl-[4-[[(2R)-4-(furan-2-yl)butan-2-yl]amino]piperidin-1-yl]methanone
SMILESC[C@H](CCc1ccco1)NC1CCN(C(=O)c2ccoc2)CC1
InChIInChI=1S/C18H24N2O3/c1-14(4-5-17-3-2-11-23-17)19-16-6-9-20(10-7-16)18(21)15-8-12-22-13-15/h2-3,8,11-14,16,19H,4-7,9-10H2,1H3/t14-/m1/s1
InChIKeyIWSRMWQSEGVTMT-CQSZACIVSA-N
XLogP3.09
TPSA58.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.40
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze furan-3-yl-[4-[[(2R)-4-(furan-2-yl)butan-2-yl]amino]piperidin-1-yl]methanone with MolForge

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Related Compounds

1-[4-[4-(furan-2-yl)butan-2-ylamino]piperidin-1-yl]ethanone
CID 43224097
1-ethylsulfonyl-N-[4-(furan-2-yl)butan-2-yl]piperidin-4-amine
CID 43478927
trans-(1R,2R)-2-[4-[[(2R)-4-(furan-2-yl)butan-2-yl]amino]piperidin-1-yl]cyclohexan-1-ol
CID 124726359
1-(furan-3-carbonyl)-N-(furan-2-ylmethyl)piperidine-4-carboxamide
CID 35550742
N-[1-(furan-3-carbonyl)piperidin-4-yl]-2-methylpropanamide
CID 38198075
1-(furan-3-carbonyl)-N-(furan-2-ylmethyl)-N-methylpiperidine-4-carboxamide
CID 35699759
N-[[1-(furan-3-carbonyl)piperidin-4-yl]methyl]-N'-(furan-2-ylmethyl)oxamide
CID 90521933
4-ethyl-N-[4-(furan-2-yl)butan-2-yl]cycloheptan-1-amine
CID 65082213
furan-3-yl-[4-[[(1R)-2-methyl-1-(2-methylphenyl)propyl]amino]piperidin-1-yl]methanone
CID 97231970
furan-3-yl-[4-[[(1S)-1-(2-hydroxyphenyl)propyl]amino]piperidin-1-yl]methanone
CID 99700469
N-[(2R)-butan-2-yl]-1-(furan-3-carbonyl)piperidine-4-carboxamide
CID 39992601
N-[(2S)-butan-2-yl]-1-(furan-3-carbonyl)piperidine-4-carboxamide
CID 39992604

Frequently Asked Questions

What is the IUPAC name of furan-3-yl-[4-[[(2R)-4-(furan-2-yl)butan-2-yl]amino]piperidin-1-yl]methanone?
The IUPAC name of furan-3-yl-[4-[[(2R)-4-(furan-2-yl)butan-2-yl]amino]piperidin-1-yl]methanone (CID 97229211) is furan-3-yl-[4-[[(2R)-4-(furan-2-yl)butan-2-yl]amino]piperidin-1-yl]methanone.
What is the SMILES notation for furan-3-yl-[4-[[(2R)-4-(furan-2-yl)butan-2-yl]amino]piperidin-1-yl]methanone?
The canonical SMILES for furan-3-yl-[4-[[(2R)-4-(furan-2-yl)butan-2-yl]amino]piperidin-1-yl]methanone is C[C@H](CCc1ccco1)NC1CCN(C(=O)c2ccoc2)CC1.
What is the InChIKey of furan-3-yl-[4-[[(2R)-4-(furan-2-yl)butan-2-yl]amino]piperidin-1-yl]methanone?
The InChIKey is IWSRMWQSEGVTMT-CQSZACIVSA-N. The full InChI is InChI=1S/C18H24N2O3/c1-14(4-5-17-3-2-11-23-17)19-16-6-9-20(10-7-16)18(21)15-8-12-22-13-15/h2-3,8,11-14,16,19H,4-7,9-10H2,1H3/t14-/m1/s1.
What are the key properties of furan-3-yl-[4-[[(2R)-4-(furan-2-yl)butan-2-yl]amino]piperidin-1-yl]methanone?
furan-3-yl-[4-[[(2R)-4-(furan-2-yl)butan-2-yl]amino]piperidin-1-yl]methanone has a molecular weight of 316.40 g/mol, XLogP of 3.09, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for furan-3-yl-[4-[[(2R)-4-(furan-2-yl)butan-2-yl]amino]piperidin-1-yl]methanone is sourced from PubChem (CID 97229211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).