5-(imidazol-1-ylmethyl)-N-[1-(oxolan-2-ylmethyl)piperidin-4-yl]furan-2-carboxamide

C19H26N4O3 — CID 118795926

IUPAC5-(imidazol-1-ylmethyl)-N-[1-(oxolan-2-ylmethyl)piperidin-4-yl]furan-2-carboxamide
SMILESO=C(NC1CCN(CC2CCCO2)CC1)c1ccc(Cn2ccnc2)o1
InChIInChI=1S/C19H26N4O3/c24-19(18-4-3-17(26-18)13-23-10-7-20-14-23)21-15-5-8-22(9-6-15)12-16-2-1-11-25-16/h3-4,7,10,14-16H,1-2,5-6,8-9,11-13H2,(H,21,24)
InChIKeyMYORXAKXXREXEL-UHFFFAOYSA-N
MW358.44 g/mol
LogP1.90
Rot. Bonds6

About 5-(imidazol-1-ylmethyl)-N-[1-(oxolan-2-ylmethyl)piperidin-4-yl]furan-2-carboxamide

5-(imidazol-1-ylmethyl)-N-[1-(oxolan-2-ylmethyl)piperidin-4-yl]furan-2-carboxamide (PubChem CID 118795926) has the molecular formula C19H26N4O3 and a molecular weight of 358.44 g/mol. Its IUPAC name is 5-(imidazol-1-ylmethyl)-N-[1-(oxolan-2-ylmethyl)piperidin-4-yl]furan-2-carboxamide.

Molecular Properties

Compound Name5-(imidazol-1-ylmethyl)-N-[1-(oxolan-2-ylmethyl)piperidin-4-yl]furan-2-carboxamide
PubChem CID118795926
Molecular FormulaC19H26N4O3
Molecular Weight358.44 g/mol
Exact Mass358.20
IUPAC Name5-(imidazol-1-ylmethyl)-N-[1-(oxolan-2-ylmethyl)piperidin-4-yl]furan-2-carboxamide
SMILESO=C(NC1CCN(CC2CCCO2)CC1)c1ccc(Cn2ccnc2)o1
InChIInChI=1S/C19H26N4O3/c24-19(18-4-3-17(26-18)13-23-10-7-20-14-23)21-15-5-8-22(9-6-15)12-16-2-1-11-25-16/h3-4,7,10,14-16H,1-2,5-6,8-9,11-13H2,(H,21,24)
InChIKeyMYORXAKXXREXEL-UHFFFAOYSA-N
XLogP1.90
TPSA72.53 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.44
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-imidazol-1-yl-N-[1-[[(2S)-oxolan-2-yl]methyl]piperidin-4-yl]butanamide
CID 125158263
4-(imidazol-1-ylmethyl)-N-[[(2R)-oxolan-2-yl]methyl]benzamide
CID 93491347
4-[[1-(oxolan-2-ylmethyl)piperidin-4-yl]carbamoyl]benzoic acid
CID 146134662
1-ethyl-N-[1-[[(2R)-oxolan-2-yl]methyl]piperidin-4-yl]pyrazole-3-carboxamide
CID 125172263
N-[1-[[(2R)-oxolan-2-yl]methyl]piperidin-4-yl]-3-pyridin-4-ylpropanamide
CID 125176299
cis-methyl (1R,2S)-2-[[5-(imidazol-1-ylmethyl)furan-2-carbonyl]amino]cycloheptane-1-carboxylate
CID 97053856
N-cyclopentyl-4-(imidazol-1-ylmethyl)benzamide
CID 43918576
methyl (1S,2R,3R,4S)-3-[[5-(imidazol-1-ylmethyl)furan-2-carbonyl]amino]bicyclo[2.2.1]heptane-2-carboxylate
CID 129432761
methyl (1S,2S,3S,4S)-3-[[5-(imidazol-1-ylmethyl)furan-2-carbonyl]amino]bicyclo[2.2.1]heptane-2-carboxylate
CID 98515091
N-[1-[[(2S)-oxolan-2-yl]methyl]piperidin-4-yl]-1H-pyrazole-4-carboxamide
CID 99929059
N-[1-[[(2S)-oxolan-2-yl]methyl]piperidin-4-yl]-3-pyrimidin-5-ylbenzamide
CID 125157089
3,5-dichloro-4-methyl-N-[1-(oxolan-2-ylmethyl)piperidin-4-yl]benzamide
CID 72896765

Frequently Asked Questions

What is the IUPAC name of 5-(imidazol-1-ylmethyl)-N-[1-(oxolan-2-ylmethyl)piperidin-4-yl]furan-2-carboxamide?
The IUPAC name of 5-(imidazol-1-ylmethyl)-N-[1-(oxolan-2-ylmethyl)piperidin-4-yl]furan-2-carboxamide (CID 118795926) is 5-(imidazol-1-ylmethyl)-N-[1-(oxolan-2-ylmethyl)piperidin-4-yl]furan-2-carboxamide.
What is the SMILES notation for 5-(imidazol-1-ylmethyl)-N-[1-(oxolan-2-ylmethyl)piperidin-4-yl]furan-2-carboxamide?
The canonical SMILES for 5-(imidazol-1-ylmethyl)-N-[1-(oxolan-2-ylmethyl)piperidin-4-yl]furan-2-carboxamide is O=C(NC1CCN(CC2CCCO2)CC1)c1ccc(Cn2ccnc2)o1.
What is the InChIKey of 5-(imidazol-1-ylmethyl)-N-[1-(oxolan-2-ylmethyl)piperidin-4-yl]furan-2-carboxamide?
The InChIKey is MYORXAKXXREXEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O3/c24-19(18-4-3-17(26-18)13-23-10-7-20-14-23)21-15-5-8-22(9-6-15)12-16-2-1-11-25-16/h3-4,7,10,14-16H,1-2,5-6,8-9,11-13H2,(H,21,24).
What are the key properties of 5-(imidazol-1-ylmethyl)-N-[1-(oxolan-2-ylmethyl)piperidin-4-yl]furan-2-carboxamide?
5-(imidazol-1-ylmethyl)-N-[1-(oxolan-2-ylmethyl)piperidin-4-yl]furan-2-carboxamide has a molecular weight of 358.44 g/mol, XLogP of 1.90, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(imidazol-1-ylmethyl)-N-[1-(oxolan-2-ylmethyl)piperidin-4-yl]furan-2-carboxamide is sourced from PubChem (CID 118795926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).