1-phenyl-2-(2-pyridin-2-ylethyl)guanidine

C14H16N4 — CID 62363835

IUPAC1-phenyl-2-(2-pyridin-2-ylethyl)guanidine
SMILESN/C(=N\CCc1ccccn1)Nc1ccccc1
InChIInChI=1S/C14H16N4/c15-14(18-13-7-2-1-3-8-13)17-11-9-12-6-4-5-10-16-12/h1-8,10H,9,11H2,(H3,15,17,18)
InChIKeyAOZRFKBVPSZPKF-UHFFFAOYSA-N
MW240.31 g/mol
LogP2.05
Rot. Bonds4

About 1-phenyl-2-(2-pyridin-2-ylethyl)guanidine

1-phenyl-2-(2-pyridin-2-ylethyl)guanidine (PubChem CID 62363835) has the molecular formula C14H16N4 and a molecular weight of 240.31 g/mol. Its IUPAC name is 1-phenyl-2-(2-pyridin-2-ylethyl)guanidine.

Molecular Properties

Compound Name1-phenyl-2-(2-pyridin-2-ylethyl)guanidine
PubChem CID62363835
Molecular FormulaC14H16N4
Molecular Weight240.31 g/mol
Exact Mass240.14
IUPAC Name1-phenyl-2-(2-pyridin-2-ylethyl)guanidine
SMILESN/C(=N\CCc1ccccn1)Nc1ccccc1
InChIInChI=1S/C14H16N4/c15-14(18-13-7-2-1-3-8-13)17-11-9-12-6-4-5-10-16-12/h1-8,10H,9,11H2,(H3,15,17,18)
InChIKeyAOZRFKBVPSZPKF-UHFFFAOYSA-N
XLogP2.05
TPSA63.30 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

1-(4-ethylphenyl)-2-(2-pyridin-2-ylethyl)guanidine
CID 111024696
1-phenyl-2-(pyridin-2-ylmethyl)guanidine
CID 62072214
1-prop-2-enyl-2-(2-pyridin-2-ylethyl)guanidine
CID 137156933
1-propan-2-yl-2-(2-pyridin-2-ylethyl)guanidine
CID 62363919
1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-pyridin-2-ylethyl)guanidine;hydroiodide
CID 111024734
2-pyridin-2-ylethanamine;2-(2-pyridin-2-ylethyl)guanidine
CID 161239172
2-[2-(1-methylpyrazol-3-yl)ethyl]-1-phenylguanidine
CID 113435090
2-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-1-phenylguanidine
CID 103635624
N-phenyl-N'-(2-pyridin-2-ylethyl)piperidine-1-carboximidamide;hydroiodide
CID 111024708
2-(2-hydroxyethyl)-1-phenylguanidine
CID 57066728
2-[2-(1,2,4-oxadiazol-3-yl)ethyl]-1-phenylguanidine
CID 106401269
1-phenyl-2-[2-(1H-1,2,4-triazol-5-yl)ethyl]guanidine
CID 64529402

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-2-(2-pyridin-2-ylethyl)guanidine?
The IUPAC name of 1-phenyl-2-(2-pyridin-2-ylethyl)guanidine (CID 62363835) is 1-phenyl-2-(2-pyridin-2-ylethyl)guanidine.
What is the SMILES notation for 1-phenyl-2-(2-pyridin-2-ylethyl)guanidine?
The canonical SMILES for 1-phenyl-2-(2-pyridin-2-ylethyl)guanidine is N/C(=N\CCc1ccccn1)Nc1ccccc1.
What is the InChIKey of 1-phenyl-2-(2-pyridin-2-ylethyl)guanidine?
The InChIKey is AOZRFKBVPSZPKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4/c15-14(18-13-7-2-1-3-8-13)17-11-9-12-6-4-5-10-16-12/h1-8,10H,9,11H2,(H3,15,17,18).
What are the key properties of 1-phenyl-2-(2-pyridin-2-ylethyl)guanidine?
1-phenyl-2-(2-pyridin-2-ylethyl)guanidine has a molecular weight of 240.31 g/mol, XLogP of 2.05, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-2-(2-pyridin-2-ylethyl)guanidine is sourced from PubChem (CID 62363835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).