N-(3-pyrazol-1-ylpropyl)pyridin-4-amine

C11H14N4 — CID 115669379

IUPACN-(3-pyrazol-1-ylpropyl)pyridin-4-amine
SMILESc1cnn(CCCNc2ccncc2)c1
InChIInChI=1S/C11H14N4/c1(9-15-10-2-6-14-15)5-13-11-3-7-12-8-4-11/h2-4,6-8,10H,1,5,9H2,(H,12,13)
InChIKeyMYODLCCXBACVTM-UHFFFAOYSA-N
MW202.26 g/mol
LogP1.78
Rot. Bonds5

About N-(3-pyrazol-1-ylpropyl)pyridin-4-amine

N-(3-pyrazol-1-ylpropyl)pyridin-4-amine (PubChem CID 115669379) has the molecular formula C11H14N4 and a molecular weight of 202.26 g/mol. Its IUPAC name is N-(3-pyrazol-1-ylpropyl)pyridin-4-amine.

Molecular Properties

Compound NameN-(3-pyrazol-1-ylpropyl)pyridin-4-amine
PubChem CID115669379
Molecular FormulaC11H14N4
Molecular Weight202.26 g/mol
Exact Mass202.12
IUPAC NameN-(3-pyrazol-1-ylpropyl)pyridin-4-amine
SMILESc1cnn(CCCNc2ccncc2)c1
InChIInChI=1S/C11H14N4/c1(9-15-10-2-6-14-15)5-13-11-3-7-12-8-4-11/h2-4,6-8,10H,1,5,9H2,(H,12,13)
InChIKeyMYODLCCXBACVTM-UHFFFAOYSA-N
XLogP1.78
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2-pyrazol-1-ylethyl)pyridin-4-amine
CID 61462969
4-N-(3-pyrazol-1-ylpropyl)benzene-1,4-diamine
CID 23104821
4-(3-pyrazol-1-ylpropylamino)pyridine-2-carbonitrile
CID 113229421
N-(3-pyrazol-1-ylpropyl)pyrazin-2-amine
CID 115580003
N-(3-pyrazol-1-ylpropyl)pyridine-4-carboxamide
CID 35285072
N,N'-dipyridin-4-ylheptane-1,7-diamine
CID 23645208
N-(3-pyrazol-1-ylpropyl)-2-(trifluoromethyl)aniline
CID 112688168
N-(3-pyrazol-1-ylpropyl)-3-(trifluoromethyl)pyridin-2-amine
CID 115579994
4-iodo-1-N-(3-pyrazol-1-ylpropyl)benzene-1,2-diamine
CID 113412372
6-N-(3-pyrazol-1-ylpropyl)pyridine-2,3,6-triamine
CID 113412388
4-butyl-N-(2-pyrazol-1-ylethyl)aniline
CID 54962348
N-[3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)propyl]pyridin-4-amine
CID 50852337

Frequently Asked Questions

What is the IUPAC name of N-(3-pyrazol-1-ylpropyl)pyridin-4-amine?
The IUPAC name of N-(3-pyrazol-1-ylpropyl)pyridin-4-amine (CID 115669379) is N-(3-pyrazol-1-ylpropyl)pyridin-4-amine.
What is the SMILES notation for N-(3-pyrazol-1-ylpropyl)pyridin-4-amine?
The canonical SMILES for N-(3-pyrazol-1-ylpropyl)pyridin-4-amine is c1cnn(CCCNc2ccncc2)c1.
What is the InChIKey of N-(3-pyrazol-1-ylpropyl)pyridin-4-amine?
The InChIKey is MYODLCCXBACVTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4/c1(9-15-10-2-6-14-15)5-13-11-3-7-12-8-4-11/h2-4,6-8,10H,1,5,9H2,(H,12,13).
What are the key properties of N-(3-pyrazol-1-ylpropyl)pyridin-4-amine?
N-(3-pyrazol-1-ylpropyl)pyridin-4-amine has a molecular weight of 202.26 g/mol, XLogP of 1.78, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-pyrazol-1-ylpropyl)pyridin-4-amine is sourced from PubChem (CID 115669379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).