(3R)-1-(furan-2-ylmethyl)-N-[(1-propylimidazol-2-yl)methyl]piperidine-3-carboxamide

C18H26N4O2 — CID 125437302

IUPAC(3R)-1-(furan-2-ylmethyl)-N-[(1-propylimidazol-2-yl)methyl]piperidine-3-carboxamide
SMILESCCCn1ccnc1CNC(=O)[C@@H]1CCCN(Cc2ccco2)C1
InChIInChI=1S/C18H26N4O2/c1-2-8-22-10-7-19-17(22)12-20-18(23)15-5-3-9-21(13-15)14-16-6-4-11-24-16/h4,6-7,10-11,15H,2-3,5,8-9,12-14H2,1H3,(H,20,23)/t15-/m1/s1
InChIKeyQECJYWCVNAORJT-OAHLLOKOSA-N
MW330.43 g/mol
LogP2.41
Rot. Bonds7

About (3R)-1-(furan-2-ylmethyl)-N-[(1-propylimidazol-2-yl)methyl]piperidine-3-carboxamide

(3R)-1-(furan-2-ylmethyl)-N-[(1-propylimidazol-2-yl)methyl]piperidine-3-carboxamide (PubChem CID 125437302) has the molecular formula C18H26N4O2 and a molecular weight of 330.43 g/mol. Its IUPAC name is (3R)-1-(furan-2-ylmethyl)-N-[(1-propylimidazol-2-yl)methyl]piperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-1-(furan-2-ylmethyl)-N-[(1-propylimidazol-2-yl)methyl]piperidine-3-carboxamide
PubChem CID125437302
Molecular FormulaC18H26N4O2
Molecular Weight330.43 g/mol
Exact Mass330.21
IUPAC Name(3R)-1-(furan-2-ylmethyl)-N-[(1-propylimidazol-2-yl)methyl]piperidine-3-carboxamide
SMILESCCCn1ccnc1CNC(=O)[C@@H]1CCCN(Cc2ccco2)C1
InChIInChI=1S/C18H26N4O2/c1-2-8-22-10-7-19-17(22)12-20-18(23)15-5-3-9-21(13-15)14-16-6-4-11-24-16/h4,6-7,10-11,15H,2-3,5,8-9,12-14H2,1H3,(H,20,23)/t15-/m1/s1
InChIKeyQECJYWCVNAORJT-OAHLLOKOSA-N
XLogP2.41
TPSA63.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.43
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(3R)-N-[(5-ethyl-1,3,4-thiadiazol-2-yl)methyl]-1-(furan-2-ylmethyl)piperidine-3-carboxamide
CID 97284250
1-(furan-2-ylmethyl)-N-[(3-pyrazol-1-ylphenyl)methyl]piperidine-3-carboxamide
CID 72886430
(3S)-N-[(2-ethyl-4-methyl-1,3-thiazol-5-yl)methyl]-1-(furan-2-ylmethyl)piperidine-3-carboxamide
CID 97283477
1-benzyl-N-(furan-2-ylmethyl)piperidine-3-carboxamide
CID 43921227
(3R)-N-[(5-chlorothiophen-2-yl)methyl]-1-(furan-2-ylmethyl)piperidine-3-carboxamide
CID 97210781
(3S)-1-(furan-2-ylmethyl)-N-[2-(1,3-thiazol-2-yl)ethyl]piperidine-3-carboxamide
CID 97186745
1-(cyclobutanecarbonyl)-N-[(1-propylimidazol-2-yl)methyl]piperidine-4-carboxamide
CID 72857945
cis-(1S,3R)-3-hydroxy-N-[(1-propylimidazol-2-yl)methyl]cyclohexane-1-carboxamide
CID 91788745
(3S)-1-(furan-2-ylmethyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]piperidine-3-carboxamide
CID 97192941
(3S)-N,N-diethyl-1-(furan-2-ylmethyl)piperidine-3-carboxamide
CID 764291
1-(furan-2-ylmethyl)-N-[2-(methylsulfamoyl)ethyl]piperidine-3-carboxamide
CID 46991870
(3S)-1-(furan-2-ylmethyl)-N-[[1-(imidazol-1-ylmethyl)cyclopropyl]methyl]piperidine-3-carboxamide
CID 95046843

Frequently Asked Questions

What is the IUPAC name of (3R)-1-(furan-2-ylmethyl)-N-[(1-propylimidazol-2-yl)methyl]piperidine-3-carboxamide?
The IUPAC name of (3R)-1-(furan-2-ylmethyl)-N-[(1-propylimidazol-2-yl)methyl]piperidine-3-carboxamide (CID 125437302) is (3R)-1-(furan-2-ylmethyl)-N-[(1-propylimidazol-2-yl)methyl]piperidine-3-carboxamide.
What is the SMILES notation for (3R)-1-(furan-2-ylmethyl)-N-[(1-propylimidazol-2-yl)methyl]piperidine-3-carboxamide?
The canonical SMILES for (3R)-1-(furan-2-ylmethyl)-N-[(1-propylimidazol-2-yl)methyl]piperidine-3-carboxamide is CCCn1ccnc1CNC(=O)[C@@H]1CCCN(Cc2ccco2)C1.
What is the InChIKey of (3R)-1-(furan-2-ylmethyl)-N-[(1-propylimidazol-2-yl)methyl]piperidine-3-carboxamide?
The InChIKey is QECJYWCVNAORJT-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H26N4O2/c1-2-8-22-10-7-19-17(22)12-20-18(23)15-5-3-9-21(13-15)14-16-6-4-11-24-16/h4,6-7,10-11,15H,2-3,5,8-9,12-14H2,1H3,(H,20,23)/t15-/m1/s1.
What are the key properties of (3R)-1-(furan-2-ylmethyl)-N-[(1-propylimidazol-2-yl)methyl]piperidine-3-carboxamide?
(3R)-1-(furan-2-ylmethyl)-N-[(1-propylimidazol-2-yl)methyl]piperidine-3-carboxamide has a molecular weight of 330.43 g/mol, XLogP of 2.41, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-(furan-2-ylmethyl)-N-[(1-propylimidazol-2-yl)methyl]piperidine-3-carboxamide is sourced from PubChem (CID 125437302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).