N-[[1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]pyrrolidin-3-yl]methyl]-3-methylfuran-2-carboxamide

C18H26N4O2 — CID 56700936

IUPACN-[[1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]pyrrolidin-3-yl]methyl]-3-methylfuran-2-carboxamide
SMILESCCc1nc(CN2CCC(CNC(=O)c3occc3C)C2)c(C)[nH]1
InChIInChI=1S/C18H26N4O2/c1-4-16-20-13(3)15(21-16)11-22-7-5-14(10-22)9-19-18(23)17-12(2)6-8-24-17/h6,8,14H,4-5,7,9-11H2,1-3H3,(H,19,23)(H,20,21)
InChIKeyKHVHTXUCRSEFBK-UHFFFAOYSA-N
MW330.43 g/mol
LogP2.43
Rot. Bonds6

About N-[[1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]pyrrolidin-3-yl]methyl]-3-methylfuran-2-carboxamide

N-[[1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]pyrrolidin-3-yl]methyl]-3-methylfuran-2-carboxamide (PubChem CID 56700936) has the molecular formula C18H26N4O2 and a molecular weight of 330.43 g/mol. Its IUPAC name is N-[[1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]pyrrolidin-3-yl]methyl]-3-methylfuran-2-carboxamide.

Molecular Properties

Compound NameN-[[1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]pyrrolidin-3-yl]methyl]-3-methylfuran-2-carboxamide
PubChem CID56700936
Molecular FormulaC18H26N4O2
Molecular Weight330.43 g/mol
Exact Mass330.21
IUPAC NameN-[[1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]pyrrolidin-3-yl]methyl]-3-methylfuran-2-carboxamide
SMILESCCc1nc(CN2CCC(CNC(=O)c3occc3C)C2)c(C)[nH]1
InChIInChI=1S/C18H26N4O2/c1-4-16-20-13(3)15(21-16)11-22-7-5-14(10-22)9-19-18(23)17-12(2)6-8-24-17/h6,8,14H,4-5,7,9-11H2,1-3H3,(H,19,23)(H,20,21)
InChIKeyKHVHTXUCRSEFBK-UHFFFAOYSA-N
XLogP2.43
TPSA74.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.43
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[[1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]pyrrolidin-3-yl]methyl]-3-methylfuran-2-carboxamide with MolForge

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Related Compounds

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N-(2-chlorophenyl)-3-[1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]piperidin-4-yl]propanamide
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N-[[1-[3-(2,4-dioxopyrimidin-1-yl)propanoyl]piperidin-3-yl]methyl]-3-methylfuran-2-carboxamide
CID 131920487
formic acid;3-methyl-N-[[1-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]piperidin-4-yl]methyl]furan-2-carboxamide
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5-methyl-N-[[1-[(2-methylphenyl)methyl]pyrrolidin-3-yl]methyl]-1,3-oxazole-4-carboxamide
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Frequently Asked Questions

What is the IUPAC name of N-[[1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]pyrrolidin-3-yl]methyl]-3-methylfuran-2-carboxamide?
The IUPAC name of N-[[1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]pyrrolidin-3-yl]methyl]-3-methylfuran-2-carboxamide (CID 56700936) is N-[[1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]pyrrolidin-3-yl]methyl]-3-methylfuran-2-carboxamide.
What is the SMILES notation for N-[[1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]pyrrolidin-3-yl]methyl]-3-methylfuran-2-carboxamide?
The canonical SMILES for N-[[1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]pyrrolidin-3-yl]methyl]-3-methylfuran-2-carboxamide is CCc1nc(CN2CCC(CNC(=O)c3occc3C)C2)c(C)[nH]1.
What is the InChIKey of N-[[1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]pyrrolidin-3-yl]methyl]-3-methylfuran-2-carboxamide?
The InChIKey is KHVHTXUCRSEFBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4O2/c1-4-16-20-13(3)15(21-16)11-22-7-5-14(10-22)9-19-18(23)17-12(2)6-8-24-17/h6,8,14H,4-5,7,9-11H2,1-3H3,(H,19,23)(H,20,21).
What are the key properties of N-[[1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]pyrrolidin-3-yl]methyl]-3-methylfuran-2-carboxamide?
N-[[1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]pyrrolidin-3-yl]methyl]-3-methylfuran-2-carboxamide has a molecular weight of 330.43 g/mol, XLogP of 2.43, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]pyrrolidin-3-yl]methyl]-3-methylfuran-2-carboxamide is sourced from PubChem (CID 56700936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).