5-cyclopropyl-N-(3-piperazin-1-ylpropyl)-1H-pyrazole-3-carboxamide

C14H23N5O — CID 119391192

IUPAC5-cyclopropyl-N-(3-piperazin-1-ylpropyl)-1H-pyrazole-3-carboxamide
SMILESO=C(NCCCN1CCNCC1)c1cc(C2CC2)[nH]n1
InChIInChI=1S/C14H23N5O/c20-14(13-10-12(17-18-13)11-2-3-11)16-4-1-7-19-8-5-15-6-9-19/h10-11,15H,1-9H2,(H,16,20)(H,17,18)
InChIKeySRUZSIBNJRJOKQ-UHFFFAOYSA-N
MW277.37 g/mol
LogP0.31
Rot. Bonds6

About 5-cyclopropyl-N-(3-piperazin-1-ylpropyl)-1H-pyrazole-3-carboxamide

5-cyclopropyl-N-(3-piperazin-1-ylpropyl)-1H-pyrazole-3-carboxamide (PubChem CID 119391192) has the molecular formula C14H23N5O and a molecular weight of 277.37 g/mol. Its IUPAC name is 5-cyclopropyl-N-(3-piperazin-1-ylpropyl)-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name5-cyclopropyl-N-(3-piperazin-1-ylpropyl)-1H-pyrazole-3-carboxamide
PubChem CID119391192
Molecular FormulaC14H23N5O
Molecular Weight277.37 g/mol
Exact Mass277.19
IUPAC Name5-cyclopropyl-N-(3-piperazin-1-ylpropyl)-1H-pyrazole-3-carboxamide
SMILESO=C(NCCCN1CCNCC1)c1cc(C2CC2)[nH]n1
InChIInChI=1S/C14H23N5O/c20-14(13-10-12(17-18-13)11-2-3-11)16-4-1-7-19-8-5-15-6-9-19/h10-11,15H,1-9H2,(H,16,20)(H,17,18)
InChIKeySRUZSIBNJRJOKQ-UHFFFAOYSA-N
XLogP0.31
TPSA73.05 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 50.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

5-tert-butyl-N-(3-piperazin-1-ylpropyl)-1H-pyrazole-3-carboxamide
CID 119393895
5-cyclopropyl-N-[3-(methylamino)propyl]-1H-pyrazole-3-carboxamide;hydrochloride
CID 119430091
5-(furan-2-yl)-N-(3-piperazin-1-ylpropyl)-1H-pyrazole-3-carboxamide;hydrochloride
CID 119393280
5-cyclopropyl-N-(3-phenothiazin-10-ylpropyl)-1H-pyrazole-3-carboxamide
CID 55652720
5-cyclopropyl-N-[2-(methylamino)ethyl]-1H-pyrazole-3-carboxamide;hydrochloride
CID 119500515
N-(cyclopropylmethyl)-5-piperidin-4-yl-1H-pyrazole-3-carboxamide
CID 112708128
N-(3-piperazin-1-ylpropyl)thiadiazole-4-carboxamide
CID 65216494
5-cyclopropyl-N-[2-(dimethylsulfamoylamino)ethyl]-1H-pyrazole-3-carboxamide
CID 138042156
N-(3-aminobutyl)-5-cyclopropyl-1H-pyrazole-3-carboxamide;hydrochloride
CID 119495448
4-acetyl-1-methyl-N-(3-piperazin-1-ylpropyl)pyrrole-2-carboxamide
CID 119391773
5-cyclopropyl-N-(pyrrolidin-2-ylmethyl)-1H-pyrazole-3-carboxamide;hydrochloride
CID 119510443
N-(3-piperazin-1-ylpropyl)-3-(1,3,5-trimethylpyrazol-4-yl)-1H-pyrazole-5-carboxamide
CID 119394475

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N-(3-piperazin-1-ylpropyl)-1H-pyrazole-3-carboxamide?
The IUPAC name of 5-cyclopropyl-N-(3-piperazin-1-ylpropyl)-1H-pyrazole-3-carboxamide (CID 119391192) is 5-cyclopropyl-N-(3-piperazin-1-ylpropyl)-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 5-cyclopropyl-N-(3-piperazin-1-ylpropyl)-1H-pyrazole-3-carboxamide?
The canonical SMILES for 5-cyclopropyl-N-(3-piperazin-1-ylpropyl)-1H-pyrazole-3-carboxamide is O=C(NCCCN1CCNCC1)c1cc(C2CC2)[nH]n1.
What is the InChIKey of 5-cyclopropyl-N-(3-piperazin-1-ylpropyl)-1H-pyrazole-3-carboxamide?
The InChIKey is SRUZSIBNJRJOKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O/c20-14(13-10-12(17-18-13)11-2-3-11)16-4-1-7-19-8-5-15-6-9-19/h10-11,15H,1-9H2,(H,16,20)(H,17,18).
What are the key properties of 5-cyclopropyl-N-(3-piperazin-1-ylpropyl)-1H-pyrazole-3-carboxamide?
5-cyclopropyl-N-(3-piperazin-1-ylpropyl)-1H-pyrazole-3-carboxamide has a molecular weight of 277.37 g/mol, XLogP of 0.31, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N-(3-piperazin-1-ylpropyl)-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 119391192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).