N-cyclopropyl-3-pyrazol-1-ylpropanamide

C9H13N3O — CID 60706933

IUPACN-cyclopropyl-3-pyrazol-1-ylpropanamide
SMILESO=C(CCn1cccn1)NC1CC1
InChIInChI=1S/C9H13N3O/c13-9(11-8-2-3-8)4-7-12-6-1-5-10-12/h1,5-6,8H,2-4,7H2,(H,11,13)
InChIKeyLBAYNULMVNIVKE-UHFFFAOYSA-N
MW179.22 g/mol
LogP0.55
Rot. Bonds4

About N-cyclopropyl-3-pyrazol-1-ylpropanamide

N-cyclopropyl-3-pyrazol-1-ylpropanamide (PubChem CID 60706933) has the molecular formula C9H13N3O and a molecular weight of 179.22 g/mol. Its IUPAC name is N-cyclopropyl-3-pyrazol-1-ylpropanamide.

Molecular Properties

Compound NameN-cyclopropyl-3-pyrazol-1-ylpropanamide
PubChem CID60706933
Molecular FormulaC9H13N3O
Molecular Weight179.22 g/mol
Exact Mass179.11
IUPAC NameN-cyclopropyl-3-pyrazol-1-ylpropanamide
SMILESO=C(CCn1cccn1)NC1CC1
InChIInChI=1S/C9H13N3O/c13-9(11-8-2-3-8)4-7-12-6-1-5-10-12/h1,5-6,8H,2-4,7H2,(H,11,13)
InChIKeyLBAYNULMVNIVKE-UHFFFAOYSA-N
XLogP0.55
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(cyclopropylcarbamoylamino)phenyl]-3-pyrazol-1-ylpropanamide
CID 87039151
N-(2-methylpiperidin-4-yl)-3-pyrazol-1-ylpropanamide
CID 106995080
N-(2-aminocyclopropyl)-3-pyrazol-1-ylpropanamide
CID 43593652
N-tert-butyl-4-(3-pyrazol-1-ylpropanoylamino)piperidine-1-carboxamide
CID 138997895
N-[3-(cyclopropylamino)propyl]-3-pyrazol-1-ylpropanamide
CID 43596290
N-[(3S)-1-cycloheptylpiperidin-3-yl]-3-pyrazol-1-ylpropanamide
CID 42452936
2-[cyclopropylmethyl-[3-(3-pyrazol-1-ylpropanoylamino)cyclobutyl]amino]acetic acid
CID 167774042
N-cyclohexyl-2-(2-pyrazol-1-ylethylamino)acetamide
CID 54951795
N-[4-(hydroxymethyl)cyclohexyl]-2-pyrazol-1-ylacetamide
CID 113384212
N-cycloheptyl-3-[(2S)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]propanamide
CID 95147558
N-cyclopropyl-2-[(2-hydroxy-3-pyrazol-1-ylpropyl)amino]acetamide
CID 54938305
N-cyclopropyl-4-[[N-ethyl-N'-(3-pyrazol-1-ylpropyl)carbamimidoyl]amino]butanamide;hydroiodide
CID 111905202

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-pyrazol-1-ylpropanamide?
The IUPAC name of N-cyclopropyl-3-pyrazol-1-ylpropanamide (CID 60706933) is N-cyclopropyl-3-pyrazol-1-ylpropanamide.
What is the SMILES notation for N-cyclopropyl-3-pyrazol-1-ylpropanamide?
The canonical SMILES for N-cyclopropyl-3-pyrazol-1-ylpropanamide is O=C(CCn1cccn1)NC1CC1.
What is the InChIKey of N-cyclopropyl-3-pyrazol-1-ylpropanamide?
The InChIKey is LBAYNULMVNIVKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O/c13-9(11-8-2-3-8)4-7-12-6-1-5-10-12/h1,5-6,8H,2-4,7H2,(H,11,13).
What are the key properties of N-cyclopropyl-3-pyrazol-1-ylpropanamide?
N-cyclopropyl-3-pyrazol-1-ylpropanamide has a molecular weight of 179.22 g/mol, XLogP of 0.55, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-pyrazol-1-ylpropanamide is sourced from PubChem (CID 60706933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).