N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide

C14H17N3O2 — CID 126801431

IUPACN-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide
SMILESCc1n[nH]c(C)c1CNC(=O)c1occ2c1CCC2
InChIInChI=1S/C14H17N3O2/c1-8-12(9(2)17-16-8)6-15-14(18)13-11-5-3-4-10(11)7-19-13/h7H,3-6H2,1-2H3,(H,15,18)(H,16,17)
InChIKeyDVMMUXUENRIISB-UHFFFAOYSA-N
MW259.31 g/mol
LogP2.04
Rot. Bonds3

About N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide

N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide (PubChem CID 126801431) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide.

Molecular Properties

Compound NameN-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide
PubChem CID126801431
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC NameN-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide
SMILESCc1n[nH]c(C)c1CNC(=O)c1occ2c1CCC2
InChIInChI=1S/C14H17N3O2/c1-8-12(9(2)17-16-8)6-15-14(18)13-11-5-3-4-10(11)7-19-13/h7H,3-6H2,1-2H3,(H,15,18)(H,16,17)
InChIKeyDVMMUXUENRIISB-UHFFFAOYSA-N
XLogP2.04
TPSA70.92 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide with MolForge

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Related Compounds

N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-3,4-dimethylbenzamide
CID 110731036
N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2-methyl-1H-imidazole-5-carboxamide
CID 110467498
N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2-phenylacetamide
CID 110442349
N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2-(1H-pyrazol-5-yl)acetamide
CID 112528463
N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-3,5,7-trimethyl-1H-indole-2-carboxamide
CID 46963623
N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-1-(4-methylanilino)cyclopentane-1-carboxamide
CID 50948994
3-amino-N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]propanamide
CID 110460201
N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-3-(1-methylpyrazol-4-yl)-1H-pyrazole-5-carboxamide
CID 46961707
N-[cyclopropyl(2H-tetrazol-5-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide
CID 166312516
N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-5-methoxy-2-methylpyridine-4-carboxamide
CID 146037964
methyl 4-[(3,5-dimethyl-1H-pyrazol-4-yl)methylamino]benzoate
CID 43645040
N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2-(trifluoromethoxy)benzamide
CID 75515842

Frequently Asked Questions

What is the IUPAC name of N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide?
The IUPAC name of N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide (CID 126801431) is N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide.
What is the SMILES notation for N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide?
The canonical SMILES for N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide is Cc1n[nH]c(C)c1CNC(=O)c1occ2c1CCC2.
What is the InChIKey of N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide?
The InChIKey is DVMMUXUENRIISB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-8-12(9(2)17-16-8)6-15-14(18)13-11-5-3-4-10(11)7-19-13/h7H,3-6H2,1-2H3,(H,15,18)(H,16,17).
What are the key properties of N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide?
N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide has a molecular weight of 259.31 g/mol, XLogP of 2.04, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide is sourced from PubChem (CID 126801431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).