4-amino-5-cyclopropyl-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]-1H-pyrazole-3-carboxamide

C14H20N6O — CID 62079735

IUPAC4-amino-5-cyclopropyl-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]-1H-pyrazole-3-carboxamide
SMILESCc1[nH]ncc1CCCNC(=O)c1n[nH]c(C2CC2)c1N
InChIInChI=1S/C14H20N6O/c1-8-10(7-17-18-8)3-2-6-16-14(21)13-11(15)12(19-20-13)9-4-5-9/h7,9H,2-6,15H2,1H3,(H,16,21)(H,17,18)(H,19,20)
InChIKeyAQRCNJVAISWCBG-UHFFFAOYSA-N
MW288.35 g/mol
LogP1.26
Rot. Bonds6

About 4-amino-5-cyclopropyl-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]-1H-pyrazole-3-carboxamide

4-amino-5-cyclopropyl-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]-1H-pyrazole-3-carboxamide (PubChem CID 62079735) has the molecular formula C14H20N6O and a molecular weight of 288.35 g/mol. Its IUPAC name is 4-amino-5-cyclopropyl-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-5-cyclopropyl-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]-1H-pyrazole-3-carboxamide
PubChem CID62079735
Molecular FormulaC14H20N6O
Molecular Weight288.35 g/mol
Exact Mass288.17
IUPAC Name4-amino-5-cyclopropyl-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]-1H-pyrazole-3-carboxamide
SMILESCc1[nH]ncc1CCCNC(=O)c1n[nH]c(C2CC2)c1N
InChIInChI=1S/C14H20N6O/c1-8-10(7-17-18-8)3-2-6-16-14(21)13-11(15)12(19-20-13)9-4-5-9/h7,9H,2-6,15H2,1H3,(H,16,21)(H,17,18)(H,19,20)
InChIKeyAQRCNJVAISWCBG-UHFFFAOYSA-N
XLogP1.26
TPSA112.48 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 51.26
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-amino-5-cyclopropyl-N-(3-sulfamoylpropyl)-1H-pyrazole-3-carboxamide
CID 62077959
N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]-2H-triazole-4-carboxamide
CID 78924905
4-amino-5-cyclopropyl-N-hex-5-ynyl-1H-pyrazole-3-carboxamide
CID 106208189
4-amino-5-cyclopropyl-N-[2-[di(propan-2-yl)amino]ethyl]-1H-pyrazole-3-carboxamide
CID 62077444
4-amino-5-cyclopropyl-N-[3-(methylamino)-3-oxopropyl]-1H-pyrazole-3-carboxamide
CID 62077794
2-cyclopentyl-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]acetamide
CID 62037988
2-amino-5-chloro-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]pyridine-4-carboxamide
CID 114922479
4-amino-5-cyclopropyl-N-[2-(dimethylsulfamoyl)ethyl]-1H-pyrazole-3-carboxamide
CID 106333015
2-(2-aminophenyl)-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]acetamide
CID 62040874
4-amino-5-cyclopropyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-1H-pyrazole-3-carboxamide
CID 106391751
4-amino-5-cyclopropyl-N-[(2S)-2-hydroxypropyl]-1H-pyrazole-3-carboxamide
CID 107211171
4-amino-N-[2-(5-bromothiophen-2-yl)ethyl]-5-cyclopropyl-1H-pyrazole-3-carboxamide
CID 106033606

Frequently Asked Questions

What is the IUPAC name of 4-amino-5-cyclopropyl-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]-1H-pyrazole-3-carboxamide?
The IUPAC name of 4-amino-5-cyclopropyl-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]-1H-pyrazole-3-carboxamide (CID 62079735) is 4-amino-5-cyclopropyl-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-5-cyclopropyl-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]-1H-pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-5-cyclopropyl-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]-1H-pyrazole-3-carboxamide is Cc1[nH]ncc1CCCNC(=O)c1n[nH]c(C2CC2)c1N.
What is the InChIKey of 4-amino-5-cyclopropyl-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]-1H-pyrazole-3-carboxamide?
The InChIKey is AQRCNJVAISWCBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N6O/c1-8-10(7-17-18-8)3-2-6-16-14(21)13-11(15)12(19-20-13)9-4-5-9/h7,9H,2-6,15H2,1H3,(H,16,21)(H,17,18)(H,19,20).
What are the key properties of 4-amino-5-cyclopropyl-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]-1H-pyrazole-3-carboxamide?
4-amino-5-cyclopropyl-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]-1H-pyrazole-3-carboxamide has a molecular weight of 288.35 g/mol, XLogP of 1.26, 6 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-cyclopropyl-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 62079735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).