N-(cyclobutylmethyl)-N-(oxolan-2-ylmethyl)-5-(pyrrolidin-1-ylmethyl)furan-2-carboxamide

C20H30N2O3 — CID 131933924

IUPACN-(cyclobutylmethyl)-N-(oxolan-2-ylmethyl)-5-(pyrrolidin-1-ylmethyl)furan-2-carboxamide
SMILESO=C(c1ccc(CN2CCCC2)o1)N(CC1CCC1)CC1CCCO1
InChIInChI=1S/C20H30N2O3/c23-20(19-9-8-18(25-19)14-21-10-1-2-11-21)22(13-16-5-3-6-16)15-17-7-4-12-24-17/h8-9,16-17H,1-7,10-15H2
InChIKeyNYTVUCNAGXUBQE-UHFFFAOYSA-N
MW346.47 g/mol
LogP3.30
Rot. Bonds7

About N-(cyclobutylmethyl)-N-(oxolan-2-ylmethyl)-5-(pyrrolidin-1-ylmethyl)furan-2-carboxamide

N-(cyclobutylmethyl)-N-(oxolan-2-ylmethyl)-5-(pyrrolidin-1-ylmethyl)furan-2-carboxamide (PubChem CID 131933924) has the molecular formula C20H30N2O3 and a molecular weight of 346.47 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-N-(oxolan-2-ylmethyl)-5-(pyrrolidin-1-ylmethyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-N-(oxolan-2-ylmethyl)-5-(pyrrolidin-1-ylmethyl)furan-2-carboxamide
PubChem CID131933924
Molecular FormulaC20H30N2O3
Molecular Weight346.47 g/mol
Exact Mass346.23
IUPAC NameN-(cyclobutylmethyl)-N-(oxolan-2-ylmethyl)-5-(pyrrolidin-1-ylmethyl)furan-2-carboxamide
SMILESO=C(c1ccc(CN2CCCC2)o1)N(CC1CCC1)CC1CCCO1
InChIInChI=1S/C20H30N2O3/c23-20(19-9-8-18(25-19)14-21-10-1-2-11-21)22(13-16-5-3-6-16)15-17-7-4-12-24-17/h8-9,16-17H,1-7,10-15H2
InChIKeyNYTVUCNAGXUBQE-UHFFFAOYSA-N
XLogP3.30
TPSA45.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.47
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-(cyclobutylmethyl)-N-[[(2R)-oxolan-2-yl]methyl]-1-benzofuran-2-carboxamide
CID 95225190
N-[[1-[(2-methylphenyl)methyl]piperidin-4-yl]methyl]-N-[[(2R)-oxolan-2-yl]methyl]furan-2-carboxamide
CID 42214950
N-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-4-yl]methyl]-5-methoxy-N-[[(2S)-oxolan-2-yl]methyl]furan-2-carboxamide
CID 42245792
N-[[1-[(2-fluorophenyl)methyl]piperidin-4-yl]methyl]-N-[[(2S)-oxolan-2-yl]methyl]-1,3-oxazole-5-carboxamide
CID 97280461
4-(azepan-1-ylmethyl)-N-(oxolan-2-ylmethyl)benzamide
CID 43921278
2-[(4-benzylpiperazin-1-yl)methyl]-N-(cyclopropylmethyl)-N-(oxolan-2-ylmethyl)-1,3-oxazole-4-carboxamide
CID 45190486
5-methyl-N-[[1-[(2-methylphenyl)methyl]piperidin-4-yl]methyl]-N-(oxolan-2-ylmethyl)pyrazine-2-carboxamide
CID 45221593
5-(methoxymethyl)-N-(oxolan-2-ylmethyl)-N-(pyridin-3-ylmethyl)furan-2-carboxamide
CID 87028392
5-(methylsulfanylmethyl)-N-(oxolan-2-ylmethyl)-N-(pyridin-4-ylmethyl)furan-2-carboxamide
CID 90648755
3-methyl-N-[[1-[(2-methylphenyl)methyl]piperidin-4-yl]methyl]-N-(oxolan-2-ylmethyl)thiophene-2-carboxamide
CID 45203929
4-methoxy-N-[[1-[(2-methylphenyl)methyl]piperidin-4-yl]methyl]-N-[[(2R)-oxolan-2-yl]methyl]benzamide
CID 42527604
N-(cyclobutylmethyl)-N-(oxolan-2-ylmethyl)-6-(1,2,4-triazol-4-yl)pyridine-3-carboxamide
CID 74234326

Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-N-(oxolan-2-ylmethyl)-5-(pyrrolidin-1-ylmethyl)furan-2-carboxamide?
The IUPAC name of N-(cyclobutylmethyl)-N-(oxolan-2-ylmethyl)-5-(pyrrolidin-1-ylmethyl)furan-2-carboxamide (CID 131933924) is N-(cyclobutylmethyl)-N-(oxolan-2-ylmethyl)-5-(pyrrolidin-1-ylmethyl)furan-2-carboxamide.
What is the SMILES notation for N-(cyclobutylmethyl)-N-(oxolan-2-ylmethyl)-5-(pyrrolidin-1-ylmethyl)furan-2-carboxamide?
The canonical SMILES for N-(cyclobutylmethyl)-N-(oxolan-2-ylmethyl)-5-(pyrrolidin-1-ylmethyl)furan-2-carboxamide is O=C(c1ccc(CN2CCCC2)o1)N(CC1CCC1)CC1CCCO1.
What is the InChIKey of N-(cyclobutylmethyl)-N-(oxolan-2-ylmethyl)-5-(pyrrolidin-1-ylmethyl)furan-2-carboxamide?
The InChIKey is NYTVUCNAGXUBQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N2O3/c23-20(19-9-8-18(25-19)14-21-10-1-2-11-21)22(13-16-5-3-6-16)15-17-7-4-12-24-17/h8-9,16-17H,1-7,10-15H2.
What are the key properties of N-(cyclobutylmethyl)-N-(oxolan-2-ylmethyl)-5-(pyrrolidin-1-ylmethyl)furan-2-carboxamide?
N-(cyclobutylmethyl)-N-(oxolan-2-ylmethyl)-5-(pyrrolidin-1-ylmethyl)furan-2-carboxamide has a molecular weight of 346.47 g/mol, XLogP of 3.30, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-N-(oxolan-2-ylmethyl)-5-(pyrrolidin-1-ylmethyl)furan-2-carboxamide is sourced from PubChem (CID 131933924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).