N-[1-[(1R)-1-(5-tert-butyl-1,3-oxazol-2-yl)ethyl]piperidin-4-yl]furan-3-carboxamide

C19H27N3O3 — CID 97220150

IUPACN-[1-[(1R)-1-(5-tert-butyl-1,3-oxazol-2-yl)ethyl]piperidin-4-yl]furan-3-carboxamide
SMILESC[C@H](c1ncc(C(C)(C)C)o1)N1CCC(NC(=O)c2ccoc2)CC1
InChIInChI=1S/C19H27N3O3/c1-13(18-20-11-16(25-18)19(2,3)4)22-8-5-15(6-9-22)21-17(23)14-7-10-24-12-14/h7,10-13,15H,5-6,8-9H2,1-4H3,(H,21,23)/t13-/m1/s1
InChIKeyZCTORUFJTOPNKK-CYBMUJFWSA-N
MW345.44 g/mol
LogP3.52
Rot. Bonds4

About N-[1-[(1R)-1-(5-tert-butyl-1,3-oxazol-2-yl)ethyl]piperidin-4-yl]furan-3-carboxamide

N-[1-[(1R)-1-(5-tert-butyl-1,3-oxazol-2-yl)ethyl]piperidin-4-yl]furan-3-carboxamide (PubChem CID 97220150) has the molecular formula C19H27N3O3 and a molecular weight of 345.44 g/mol. Its IUPAC name is N-[1-[(1R)-1-(5-tert-butyl-1,3-oxazol-2-yl)ethyl]piperidin-4-yl]furan-3-carboxamide.

Molecular Properties

Compound NameN-[1-[(1R)-1-(5-tert-butyl-1,3-oxazol-2-yl)ethyl]piperidin-4-yl]furan-3-carboxamide
PubChem CID97220150
Molecular FormulaC19H27N3O3
Molecular Weight345.44 g/mol
Exact Mass345.21
IUPAC NameN-[1-[(1R)-1-(5-tert-butyl-1,3-oxazol-2-yl)ethyl]piperidin-4-yl]furan-3-carboxamide
SMILESC[C@H](c1ncc(C(C)(C)C)o1)N1CCC(NC(=O)c2ccoc2)CC1
InChIInChI=1S/C19H27N3O3/c1-13(18-20-11-16(25-18)19(2,3)4)22-8-5-15(6-9-22)21-17(23)14-7-10-24-12-14/h7,10-13,15H,5-6,8-9H2,1-4H3,(H,21,23)/t13-/m1/s1
InChIKeyZCTORUFJTOPNKK-CYBMUJFWSA-N
XLogP3.52
TPSA71.51 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.44
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[1-[(1R)-1-(5-tert-butyl-1,3-oxazol-2-yl)ethyl]piperidin-4-yl]furan-3-carboxamide with MolForge

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Related Compounds

5-{[{[2-(3-Furyl)-5-methyl-1,3-oxazol-4-yl]methyl}(isopropyl)amino]methyl}pyrrolidin-2-one
CID 16188288
N-[1-(5-propan-2-yl-1,3-oxazole-4-carbonyl)piperidin-4-yl]furan-3-carboxamide
CID 75370530
Methyl 2-[1-[[2-(furan-3-yl)-5-methyl-1,3-oxazol-4-yl]methyl]-3-oxopiperazin-2-yl]acetate
CID 45193959
4-[[2-(Furan-3-yl)-5-methyl-1,3-oxazol-4-yl]methyl]-3,3-dimethylpiperazin-2-one
CID 30957293
(3S)-1-ethyl-4-{[2-(3-furyl)-5-methyl-1,3-oxazol-4-yl]methyl}-3-methyl-2-piperazinone
CID 31134214
N-[2-[1-[[2-(furan-3-yl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidin-2-yl]ethyl]acetamide
CID 45176365
"N-({5-methyl-4-[(4-methylpiperidino)carbonyl]-1,3-oxazol-2-yl}methyl)-3-furamide"
CID 53195449
N,N-Diethyl-2-{[(furan-3-YL)formamido]methyl}-5-methyl-1,3-oxazole-4-carboxamide
CID 53195579
[4-[(5-Tert-butyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl]-(furan-3-yl)methanone
CID 56812069
[4-[(5-Tert-butyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl]-(2-methylfuran-3-yl)methanone
CID 56817174
2-{1-(3-Furylmethyl)-4-[(5-methyl-1,3-oxazol-4-yl)carbonyl]piperazin-2-yl}ethanol
CID 74233669
N-[1-[1-(5-tert-butyl-1,3-oxazol-2-yl)ethyl]piperidin-4-yl]furan-3-carboxamide
CID 75376162

Frequently Asked Questions

What is the IUPAC name of N-[1-[(1R)-1-(5-tert-butyl-1,3-oxazol-2-yl)ethyl]piperidin-4-yl]furan-3-carboxamide?
The IUPAC name of N-[1-[(1R)-1-(5-tert-butyl-1,3-oxazol-2-yl)ethyl]piperidin-4-yl]furan-3-carboxamide (CID 97220150) is N-[1-[(1R)-1-(5-tert-butyl-1,3-oxazol-2-yl)ethyl]piperidin-4-yl]furan-3-carboxamide.
What is the SMILES notation for N-[1-[(1R)-1-(5-tert-butyl-1,3-oxazol-2-yl)ethyl]piperidin-4-yl]furan-3-carboxamide?
The canonical SMILES for N-[1-[(1R)-1-(5-tert-butyl-1,3-oxazol-2-yl)ethyl]piperidin-4-yl]furan-3-carboxamide is C[C@H](c1ncc(C(C)(C)C)o1)N1CCC(NC(=O)c2ccoc2)CC1.
What is the InChIKey of N-[1-[(1R)-1-(5-tert-butyl-1,3-oxazol-2-yl)ethyl]piperidin-4-yl]furan-3-carboxamide?
The InChIKey is ZCTORUFJTOPNKK-CYBMUJFWSA-N. The full InChI is InChI=1S/C19H27N3O3/c1-13(18-20-11-16(25-18)19(2,3)4)22-8-5-15(6-9-22)21-17(23)14-7-10-24-12-14/h7,10-13,15H,5-6,8-9H2,1-4H3,(H,21,23)/t13-/m1/s1.
What are the key properties of N-[1-[(1R)-1-(5-tert-butyl-1,3-oxazol-2-yl)ethyl]piperidin-4-yl]furan-3-carboxamide?
N-[1-[(1R)-1-(5-tert-butyl-1,3-oxazol-2-yl)ethyl]piperidin-4-yl]furan-3-carboxamide has a molecular weight of 345.44 g/mol, XLogP of 3.52, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(1R)-1-(5-tert-butyl-1,3-oxazol-2-yl)ethyl]piperidin-4-yl]furan-3-carboxamide is sourced from PubChem (CID 97220150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).