N-(furan-2-ylmethyl)-N-[(1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]-2-oxoimidazolidine-1-carboxamide

C17H21N5O3 — CID 86266549

IUPACN-(furan-2-ylmethyl)-N-[(1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]-2-oxoimidazolidine-1-carboxamide
SMILESCn1nc(CN(Cc2ccco2)C(=O)N2CCNC2=O)c2c1CCC2
InChIInChI=1S/C17H21N5O3/c1-20-15-6-2-5-13(15)14(19-20)11-21(10-12-4-3-9-25-12)17(24)22-8-7-18-16(22)23/h3-4,9H,2,5-8,10-11H2,1H3,(H,18,23)
InChIKeyMACVETKMYRJWOY-UHFFFAOYSA-N
MW343.39 g/mol
LogP1.65
Rot. Bonds4

About N-(furan-2-ylmethyl)-N-[(1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]-2-oxoimidazolidine-1-carboxamide

N-(furan-2-ylmethyl)-N-[(1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]-2-oxoimidazolidine-1-carboxamide (PubChem CID 86266549) has the molecular formula C17H21N5O3 and a molecular weight of 343.39 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-N-[(1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]-2-oxoimidazolidine-1-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-N-[(1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]-2-oxoimidazolidine-1-carboxamide
PubChem CID86266549
Molecular FormulaC17H21N5O3
Molecular Weight343.39 g/mol
Exact Mass343.16
IUPAC NameN-(furan-2-ylmethyl)-N-[(1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]-2-oxoimidazolidine-1-carboxamide
SMILESCn1nc(CN(Cc2ccco2)C(=O)N2CCNC2=O)c2c1CCC2
InChIInChI=1S/C17H21N5O3/c1-20-15-6-2-5-13(15)14(19-20)11-21(10-12-4-3-9-25-12)17(24)22-8-7-18-16(22)23/h3-4,9H,2,5-8,10-11H2,1H3,(H,18,23)
InChIKeyMACVETKMYRJWOY-UHFFFAOYSA-N
XLogP1.65
TPSA83.61 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.39
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(E)-N-(furan-2-ylmethyl)-N-[(1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]-3-thiophen-2-ylprop-2-enamide
CID 86266511
1-[2-(furan-2-ylmethylsulfanyl)acetyl]imidazolidin-2-one
CID 112780791
N-(furan-2-ylmethyl)-N-(3-methylbutan-2-yl)-1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carboxamide
CID 46999123
N-(furan-2-ylmethyl)-N,1-dimethyl-5-thiomorpholin-4-yl-4,5,6,7-tetrahydroindazole-3-carboxamide
CID 45164401
N-benzyl-N-ethyl-1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide
CID 110389010
1-ethyl-1-(furan-2-ylmethyl)-3-[(3S)-2-oxoazepan-3-yl]urea
CID 94058653
3-(furan-2-ylmethyl)-2-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]sulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
CID 17422349
1-ethyl-1-(furan-2-ylmethyl)-3,3-dimethylurea
CID 115581572
N,1-dimethyl-N-[(6-oxo-1H-pyridin-2-yl)methyl]-4,5,6,7-tetrahydroindazole-3-carboxamide
CID 136566796
N-(furan-2-ylmethyl)-N-(oxolan-2-ylmethyl)morpholine-4-carboxamide
CID 665462
N,N-bis(furan-2-ylmethyl)-1-(2-methoxyethyl)-6-oxopyridazine-3-carboxamide
CID 46599486
N-benzyl-3-(2,5-dioxopyrrolidin-1-yl)-N-(furan-2-ylmethyl)propanamide
CID 37428744

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-N-[(1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]-2-oxoimidazolidine-1-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-N-[(1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]-2-oxoimidazolidine-1-carboxamide (CID 86266549) is N-(furan-2-ylmethyl)-N-[(1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]-2-oxoimidazolidine-1-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-N-[(1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]-2-oxoimidazolidine-1-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-N-[(1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]-2-oxoimidazolidine-1-carboxamide is Cn1nc(CN(Cc2ccco2)C(=O)N2CCNC2=O)c2c1CCC2.
What is the InChIKey of N-(furan-2-ylmethyl)-N-[(1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]-2-oxoimidazolidine-1-carboxamide?
The InChIKey is MACVETKMYRJWOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N5O3/c1-20-15-6-2-5-13(15)14(19-20)11-21(10-12-4-3-9-25-12)17(24)22-8-7-18-16(22)23/h3-4,9H,2,5-8,10-11H2,1H3,(H,18,23).
What are the key properties of N-(furan-2-ylmethyl)-N-[(1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]-2-oxoimidazolidine-1-carboxamide?
N-(furan-2-ylmethyl)-N-[(1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]-2-oxoimidazolidine-1-carboxamide has a molecular weight of 343.39 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-N-[(1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methyl]-2-oxoimidazolidine-1-carboxamide is sourced from PubChem (CID 86266549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).