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

C14H21N5O — CID 91960546

IUPACN-cyclopropyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide
SMILESCc1nn(C(C)C)c2cnn(CCC(=O)NC3CC3)c12
InChIInChI=1S/C14H21N5O/c1-9(2)19-12-8-15-18(14(12)10(3)17-19)7-6-13(20)16-11-4-5-11/h8-9,11H,4-7H2,1-3H3,(H,16,20)
InChIKeyMHODBBAJMLJTIK-UHFFFAOYSA-N
MW275.36 g/mol
LogP1.79
Rot. Bonds5

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

N-cyclopropyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide (PubChem CID 91960546) has the molecular formula C14H21N5O and a molecular weight of 275.36 g/mol. Its IUPAC name is N-cyclopropyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide.

Molecular Properties

Compound NameN-cyclopropyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide
PubChem CID91960546
Molecular FormulaC14H21N5O
Molecular Weight275.36 g/mol
Exact Mass275.17
IUPAC NameN-cyclopropyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide
SMILESCc1nn(C(C)C)c2cnn(CCC(=O)NC3CC3)c12
InChIInChI=1S/C14H21N5O/c1-9(2)19-12-8-15-18(14(12)10(3)17-19)7-6-13(20)16-11-4-5-11/h8-9,11H,4-7H2,1-3H3,(H,16,20)
InChIKeyMHODBBAJMLJTIK-UHFFFAOYSA-N
XLogP1.79
TPSA64.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclododecyl-3-(4,6-dimethylpyrazolo[5,4-d]pyrazol-1-yl)propanamide
CID 91960258
tert-butyl N-[1-[3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanoyl]piperidin-4-yl]carbamate
CID 91960631
3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)-N-(1,2-oxazol-3-yl)propanamide
CID 91960578
N-methoxy-N-methyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide
CID 91960632
N-cyclopropyl-3-(4-iodo-5-methylpyrazol-1-yl)propanamide
CID 19551987
3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)-1-(4-propan-2-ylsulfonylpiperazin-1-yl)propan-1-one
CID 91960490
N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]-3-(4,6-dimethylpyrazolo[5,4-d]pyrazol-1-yl)propanamide
CID 91960266
N-(furan-2-ylmethyl)-N-methyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide
CID 91960466
2-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)-N-(1-pyridin-4-ylethyl)acetamide
CID 56730012
N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]-3-(4-ethyl-6-methylpyrazolo[5,4-d]pyrazol-1-yl)propanamide
CID 91960418
N-cyclopropyl-3-(4-methylpyrazol-1-yl)propanamide
CID 19559575
4-[(4-amino-3-methyl-1-propan-2-ylpyrazol-5-yl)amino]-N-cyclopropylbutanamide
CID 79394730

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide?
The IUPAC name of N-cyclopropyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide (CID 91960546) is N-cyclopropyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide.
What is the SMILES notation for N-cyclopropyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide?
The canonical SMILES for N-cyclopropyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide is Cc1nn(C(C)C)c2cnn(CCC(=O)NC3CC3)c12.
What is the InChIKey of N-cyclopropyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide?
The InChIKey is MHODBBAJMLJTIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O/c1-9(2)19-12-8-15-18(14(12)10(3)17-19)7-6-13(20)16-11-4-5-11/h8-9,11H,4-7H2,1-3H3,(H,16,20).
What are the key properties of N-cyclopropyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide?
N-cyclopropyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide has a molecular weight of 275.36 g/mol, XLogP of 1.79, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-(6-methyl-4-propan-2-ylpyrazolo[5,4-d]pyrazol-1-yl)propanamide is sourced from PubChem (CID 91960546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).