N-(furan-2-ylmethyl)-N-methyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide

C17H23N5O2 — CID 91960466

IUPACN-(furan-2-ylmethyl)-N-methyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide
SMILESCc1nn(C(C)C)c2cnn(CCC(=O)N(C)Cc3ccco3)c12
InChIInChI=1S/C17H23N5O2/c1-12(2)22-15-10-18-21(17(15)13(3)19-22)8-7-16(23)20(4)11-14-6-5-9-24-14/h5-6,9-10,12H,7-8,11H2,1-4H3
InChIKeyIIZDEZDZIHNGJL-UHFFFAOYSA-N
MW329.40 g/mol
LogP2.76
Rot. Bonds6

About N-(furan-2-ylmethyl)-N-methyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide

N-(furan-2-ylmethyl)-N-methyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide (PubChem CID 91960466) has the molecular formula C17H23N5O2 and a molecular weight of 329.40 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-N-methyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-N-methyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide
PubChem CID91960466
Molecular FormulaC17H23N5O2
Molecular Weight329.40 g/mol
Exact Mass329.19
IUPAC NameN-(furan-2-ylmethyl)-N-methyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide
SMILESCc1nn(C(C)C)c2cnn(CCC(=O)N(C)Cc3ccco3)c12
InChIInChI=1S/C17H23N5O2/c1-12(2)22-15-10-18-21(17(15)13(3)19-22)8-7-16(23)20(4)11-14-6-5-9-24-14/h5-6,9-10,12H,7-8,11H2,1-4H3
InChIKeyIIZDEZDZIHNGJL-UHFFFAOYSA-N
XLogP2.76
TPSA69.09 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

N,N-diethyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide
CID 91960532
N-methoxy-N-methyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide
CID 91960632
N-benzyl-3-(4,6-dimethylpyrazolo[5,4-d]pyrazol-1-yl)-N-methylpropanamide
CID 91960269
3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)-N-(1,2-oxazol-3-yl)propanamide
CID 91960578
N-[(5-bromofuran-2-yl)methyl]-3-(4-ethyl-6-methylpyrazolo[5,4-d]pyrazol-1-yl)-N-methylpropanamide
CID 91960349
N-benzyl-3-(4-ethyl-6-methylpyrazolo[5,4-d]pyrazol-1-yl)-N-methylpropanamide
CID 91960421
N-cyclopropyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide
CID 91960546
4-amino-N-(furan-2-ylmethyl)-N-methylpentanamide;hydrochloride
CID 120566075
N-(furan-2-ylmethyl)-N-methyl-2-[[(2R)-1-(4-methylpyrazol-1-yl)propan-2-yl]amino]acetamide
CID 95306746
N-(furan-2-ylmethyl)-N,3-dimethylbutanamide
CID 58845598
N-(furan-2-ylmethyl)-N-methyl-3-(3-methyl-2-oxobenzimidazol-1-yl)propanamide
CID 18142231
N-(furan-2-ylmethyl)-N-methyl-2-(methylamino)acetamide
CID 43396056

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-N-methyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide?
The IUPAC name of N-(furan-2-ylmethyl)-N-methyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide (CID 91960466) is N-(furan-2-ylmethyl)-N-methyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-N-methyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide?
The canonical SMILES for N-(furan-2-ylmethyl)-N-methyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide is Cc1nn(C(C)C)c2cnn(CCC(=O)N(C)Cc3ccco3)c12.
What is the InChIKey of N-(furan-2-ylmethyl)-N-methyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide?
The InChIKey is IIZDEZDZIHNGJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N5O2/c1-12(2)22-15-10-18-21(17(15)13(3)19-22)8-7-16(23)20(4)11-14-6-5-9-24-14/h5-6,9-10,12H,7-8,11H2,1-4H3.
What are the key properties of N-(furan-2-ylmethyl)-N-methyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide?
N-(furan-2-ylmethyl)-N-methyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide has a molecular weight of 329.40 g/mol, XLogP of 2.76, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-N-methyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide is sourced from PubChem (CID 91960466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).