N-(3-pyrazol-1-ylpropyl)pyrazin-2-amine

C10H13N5 — CID 115580003

IUPACN-(3-pyrazol-1-ylpropyl)pyrazin-2-amine
SMILESc1cnn(CCCNc2cnccn2)c1
InChIInChI=1S/C10H13N5/c1(7-15-8-2-4-14-15)3-12-10-9-11-5-6-13-10/h2,4-6,8-9H,1,3,7H2,(H,12,13)
InChIKeyQWHPNQWORYEQNG-UHFFFAOYSA-N
MW203.25 g/mol
LogP1.18
Rot. Bonds5

About N-(3-pyrazol-1-ylpropyl)pyrazin-2-amine

N-(3-pyrazol-1-ylpropyl)pyrazin-2-amine (PubChem CID 115580003) has the molecular formula C10H13N5 and a molecular weight of 203.25 g/mol. Its IUPAC name is N-(3-pyrazol-1-ylpropyl)pyrazin-2-amine.

Molecular Properties

Compound NameN-(3-pyrazol-1-ylpropyl)pyrazin-2-amine
PubChem CID115580003
Molecular FormulaC10H13N5
Molecular Weight203.25 g/mol
Exact Mass203.12
IUPAC NameN-(3-pyrazol-1-ylpropyl)pyrazin-2-amine
SMILESc1cnn(CCCNc2cnccn2)c1
InChIInChI=1S/C10H13N5/c1(7-15-8-2-4-14-15)3-12-10-9-11-5-6-13-10/h2,4-6,8-9H,1,3,7H2,(H,12,13)
InChIKeyQWHPNQWORYEQNG-UHFFFAOYSA-N
XLogP1.18
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.25
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-(3-pyrazol-1-ylpropyl)pyridin-4-amine
CID 115669379
5-chloro-N-(3-pyrazol-1-ylpropyl)pyrimidin-4-amine
CID 105369599
N-(3-pyrazol-1-ylpropyl)-1,3-thiazol-2-amine
CID 115579999
3-(3-pyrazol-1-ylpropylamino)pyrazine-2-carboxylic acid
CID 113413256
methyl 6-(3-pyrazol-1-ylpropylamino)pyrazine-2-carboxylate
CID 113247403
4-N-(3-pyrazol-1-ylpropyl)benzene-1,4-diamine
CID 23104821
6-N-(3-pyrazol-1-ylpropyl)pyridine-2,3,6-triamine
CID 113412388
4-N-(3-pyrazol-1-ylpropyl)-6-(trifluoromethyl)pyridine-3,4-diamine
CID 106748029
N'-pyrazin-2-ylhexane-1,6-diamine
CID 107845150
5-bromo-3-methyl-N-(3-pyrazol-1-ylpropyl)pyridin-2-amine
CID 112697448
3-(3-pyrazol-1-ylpropylamino)-1H-pyrazin-2-one
CID 115657026
3-bromo-4-methyl-2-N-(3-pyrazol-1-ylpropyl)pyridine-2,5-diamine
CID 113420539

Frequently Asked Questions

What is the IUPAC name of N-(3-pyrazol-1-ylpropyl)pyrazin-2-amine?
The IUPAC name of N-(3-pyrazol-1-ylpropyl)pyrazin-2-amine (CID 115580003) is N-(3-pyrazol-1-ylpropyl)pyrazin-2-amine.
What is the SMILES notation for N-(3-pyrazol-1-ylpropyl)pyrazin-2-amine?
The canonical SMILES for N-(3-pyrazol-1-ylpropyl)pyrazin-2-amine is c1cnn(CCCNc2cnccn2)c1.
What is the InChIKey of N-(3-pyrazol-1-ylpropyl)pyrazin-2-amine?
The InChIKey is QWHPNQWORYEQNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5/c1(7-15-8-2-4-14-15)3-12-10-9-11-5-6-13-10/h2,4-6,8-9H,1,3,7H2,(H,12,13).
What are the key properties of N-(3-pyrazol-1-ylpropyl)pyrazin-2-amine?
N-(3-pyrazol-1-ylpropyl)pyrazin-2-amine has a molecular weight of 203.25 g/mol, XLogP of 1.18, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-pyrazol-1-ylpropyl)pyrazin-2-amine is sourced from PubChem (CID 115580003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).