N-cyclopropyl-3-[1-[5-(cyclopropylmethoxy)-3-pyridinyl]pyrazol-4-yl]-4-methylbenzamide

C23H24N4O2 — CID 134325397

IUPACN-cyclopropyl-3-[1-[5-(cyclopropylmethoxy)-3-pyridinyl]pyrazol-4-yl]-4-methylbenzamide
SMILESCc1ccc(C(=O)NC2CC2)cc1-c1cnn(-c2cncc(OCC3CC3)c2)c1
InChIInChI=1S/C23H24N4O2/c1-15-2-5-17(23(28)26-19-6-7-19)8-22(15)18-10-25-27(13-18)20-9-21(12-24-11-20)29-14-16-3-4-16/h2,5,8-13,16,19H,3-4,6-7,14H2,1H3,(H,26,28)
InChIKeyPWNFJDAYEGNHCU-UHFFFAOYSA-N
MW388.47 g/mol
LogP3.92
Rot. Bonds7

About N-cyclopropyl-3-[1-[5-(cyclopropylmethoxy)-3-pyridinyl]pyrazol-4-yl]-4-methylbenzamide

N-cyclopropyl-3-[1-[5-(cyclopropylmethoxy)-3-pyridinyl]pyrazol-4-yl]-4-methylbenzamide (PubChem CID 134325397) has the molecular formula C23H24N4O2 and a molecular weight of 388.47 g/mol. Its IUPAC name is N-cyclopropyl-3-[1-[5-(cyclopropylmethoxy)-3-pyridinyl]pyrazol-4-yl]-4-methylbenzamide.

Molecular Properties

Compound NameN-cyclopropyl-3-[1-[5-(cyclopropylmethoxy)-3-pyridinyl]pyrazol-4-yl]-4-methylbenzamide
PubChem CID134325397
Molecular FormulaC23H24N4O2
Molecular Weight388.47 g/mol
Exact Mass388.19
IUPAC NameN-cyclopropyl-3-[1-[5-(cyclopropylmethoxy)-3-pyridinyl]pyrazol-4-yl]-4-methylbenzamide
SMILESCc1ccc(C(=O)NC2CC2)cc1-c1cnn(-c2cncc(OCC3CC3)c2)c1
InChIInChI=1S/C23H24N4O2/c1-15-2-5-17(23(28)26-19-6-7-19)8-22(15)18-10-25-27(13-18)20-9-21(12-24-11-20)29-14-16-3-4-16/h2,5,8-13,16,19H,3-4,6-7,14H2,1H3,(H,26,28)
InChIKeyPWNFJDAYEGNHCU-UHFFFAOYSA-N
XLogP3.92
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-cyclopropyl-3-[1-[5-(cyclopropylmethoxy)-3-pyridinyl]pyrazol-4-yl]-4-methylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[1-[5-(cyclopropylmethoxy)-3-pyridinyl]pyrazol-4-yl]-4-methylbenzamide?
The IUPAC name of N-cyclopropyl-3-[1-[5-(cyclopropylmethoxy)-3-pyridinyl]pyrazol-4-yl]-4-methylbenzamide (CID 134325397) is N-cyclopropyl-3-[1-[5-(cyclopropylmethoxy)-3-pyridinyl]pyrazol-4-yl]-4-methylbenzamide.
What is the SMILES notation for N-cyclopropyl-3-[1-[5-(cyclopropylmethoxy)-3-pyridinyl]pyrazol-4-yl]-4-methylbenzamide?
The canonical SMILES for N-cyclopropyl-3-[1-[5-(cyclopropylmethoxy)-3-pyridinyl]pyrazol-4-yl]-4-methylbenzamide is Cc1ccc(C(=O)NC2CC2)cc1-c1cnn(-c2cncc(OCC3CC3)c2)c1.
What is the InChIKey of N-cyclopropyl-3-[1-[5-(cyclopropylmethoxy)-3-pyridinyl]pyrazol-4-yl]-4-methylbenzamide?
The InChIKey is PWNFJDAYEGNHCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O2/c1-15-2-5-17(23(28)26-19-6-7-19)8-22(15)18-10-25-27(13-18)20-9-21(12-24-11-20)29-14-16-3-4-16/h2,5,8-13,16,19H,3-4,6-7,14H2,1H3,(H,26,28).
What are the key properties of N-cyclopropyl-3-[1-[5-(cyclopropylmethoxy)-3-pyridinyl]pyrazol-4-yl]-4-methylbenzamide?
N-cyclopropyl-3-[1-[5-(cyclopropylmethoxy)-3-pyridinyl]pyrazol-4-yl]-4-methylbenzamide has a molecular weight of 388.47 g/mol, XLogP of 3.92, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[1-[5-(cyclopropylmethoxy)-3-pyridinyl]pyrazol-4-yl]-4-methylbenzamide is sourced from PubChem (CID 134325397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).