N-cyclopropyl-5-methyl-1-propyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrazole-4-carboxamide

C18H27N5O — CID 72884307

IUPACN-cyclopropyl-5-methyl-1-propyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrazole-4-carboxamide
SMILESCCCn1ncc(C(=O)N(Cc2c(C)nn(C)c2C)C2CC2)c1C
InChIInChI=1S/C18H27N5O/c1-6-9-23-14(4)16(10-19-23)18(24)22(15-7-8-15)11-17-12(2)20-21(5)13(17)3/h10,15H,6-9,11H2,1-5H3
InChIKeyLDDHIGSWOTXGQP-UHFFFAOYSA-N
MW329.45 g/mol
LogP2.76
Rot. Bonds6

About N-cyclopropyl-5-methyl-1-propyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrazole-4-carboxamide

N-cyclopropyl-5-methyl-1-propyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrazole-4-carboxamide (PubChem CID 72884307) has the molecular formula C18H27N5O and a molecular weight of 329.45 g/mol. Its IUPAC name is N-cyclopropyl-5-methyl-1-propyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrazole-4-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-5-methyl-1-propyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrazole-4-carboxamide
PubChem CID72884307
Molecular FormulaC18H27N5O
Molecular Weight329.45 g/mol
Exact Mass329.22
IUPAC NameN-cyclopropyl-5-methyl-1-propyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrazole-4-carboxamide
SMILESCCCn1ncc(C(=O)N(Cc2c(C)nn(C)c2C)C2CC2)c1C
InChIInChI=1S/C18H27N5O/c1-6-9-23-14(4)16(10-19-23)18(24)22(15-7-8-15)11-17-12(2)20-21(5)13(17)3/h10,15H,6-9,11H2,1-5H3
InChIKeyLDDHIGSWOTXGQP-UHFFFAOYSA-N
XLogP2.76
TPSA55.95 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.45
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-cyclopropyl-5-methyl-1-propyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrazole-4-carboxamide 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-5-methyl-1-propyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrazole-4-carboxamide?
The IUPAC name of N-cyclopropyl-5-methyl-1-propyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrazole-4-carboxamide (CID 72884307) is N-cyclopropyl-5-methyl-1-propyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrazole-4-carboxamide.
What is the SMILES notation for N-cyclopropyl-5-methyl-1-propyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrazole-4-carboxamide?
The canonical SMILES for N-cyclopropyl-5-methyl-1-propyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrazole-4-carboxamide is CCCn1ncc(C(=O)N(Cc2c(C)nn(C)c2C)C2CC2)c1C.
What is the InChIKey of N-cyclopropyl-5-methyl-1-propyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrazole-4-carboxamide?
The InChIKey is LDDHIGSWOTXGQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N5O/c1-6-9-23-14(4)16(10-19-23)18(24)22(15-7-8-15)11-17-12(2)20-21(5)13(17)3/h10,15H,6-9,11H2,1-5H3.
What are the key properties of N-cyclopropyl-5-methyl-1-propyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrazole-4-carboxamide?
N-cyclopropyl-5-methyl-1-propyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrazole-4-carboxamide has a molecular weight of 329.45 g/mol, XLogP of 2.76, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-methyl-1-propyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrazole-4-carboxamide is sourced from PubChem (CID 72884307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).