1-cyclopropyl-2-(pyridin-4-ylmethyl)guanidine

C10H14N4 — CID 62362184

IUPAC1-cyclopropyl-2-(pyridin-4-ylmethyl)guanidine
SMILESN/C(=N\Cc1ccncc1)NC1CC1
InChIInChI=1S/C10H14N4/c11-10(14-9-1-2-9)13-7-8-3-5-12-6-4-8/h3-6,9H,1-2,7H2,(H3,11,13,14)
InChIKeyKWEPFURERGZOLV-UHFFFAOYSA-N
MW190.25 g/mol
LogP0.65
Rot. Bonds3

About 1-cyclopropyl-2-(pyridin-4-ylmethyl)guanidine

1-cyclopropyl-2-(pyridin-4-ylmethyl)guanidine (PubChem CID 62362184) has the molecular formula C10H14N4 and a molecular weight of 190.25 g/mol. Its IUPAC name is 1-cyclopropyl-2-(pyridin-4-ylmethyl)guanidine.

Molecular Properties

Compound Name1-cyclopropyl-2-(pyridin-4-ylmethyl)guanidine
PubChem CID62362184
Molecular FormulaC10H14N4
Molecular Weight190.25 g/mol
Exact Mass190.12
IUPAC Name1-cyclopropyl-2-(pyridin-4-ylmethyl)guanidine
SMILESN/C(=N\Cc1ccncc1)NC1CC1
InChIInChI=1S/C10H14N4/c11-10(14-9-1-2-9)13-7-8-3-5-12-6-4-8/h3-6,9H,1-2,7H2,(H3,11,13,14)
InChIKeyKWEPFURERGZOLV-UHFFFAOYSA-N
XLogP0.65
TPSA63.30 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 50.65
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-amino-2-(pyridin-4-ylmethyl)guanidine
CID 23471425
1-cyclopropyl-2-[(3-methyl-4-pyridinyl)methyl]guanidine
CID 114700716
1-cyclopropyl-2-[(4-pyrazol-1-ylphenyl)methyl]guanidine
CID 110916114
2-[(4-cyanophenyl)methyl]-1-cyclopropylguanidine;hydroiodide
CID 110911948
1-cyclopropyl-2-[(4-ethyl-2-pyridinyl)methyl]guanidine
CID 122082620
1-cyclopropyl-2-(thiophen-3-ylmethyl)guanidine
CID 62407822
1-cyclopropyl-2-[(4-methylsulfonylphenyl)methyl]guanidine
CID 62364011
1-cyclopropyl-2-[(4-methoxy-3-pyridinyl)methyl]guanidine
CID 122082803
2-[(6-chloro-3-pyridinyl)methyl]-1-cyclopropylguanidine;hydroiodide
CID 110916460
1-cyclopropyl-2-[(3-methylphenyl)methyl]guanidine
CID 62361764
1-cyclopropyl-2-(quinolin-4-ylmethyl)guanidine
CID 111751900
2-(pyridin-4-ylmethyl)guanidine;tetrahydrochloride
CID 23471478

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-(pyridin-4-ylmethyl)guanidine?
The IUPAC name of 1-cyclopropyl-2-(pyridin-4-ylmethyl)guanidine (CID 62362184) is 1-cyclopropyl-2-(pyridin-4-ylmethyl)guanidine.
What is the SMILES notation for 1-cyclopropyl-2-(pyridin-4-ylmethyl)guanidine?
The canonical SMILES for 1-cyclopropyl-2-(pyridin-4-ylmethyl)guanidine is N/C(=N\Cc1ccncc1)NC1CC1.
What is the InChIKey of 1-cyclopropyl-2-(pyridin-4-ylmethyl)guanidine?
The InChIKey is KWEPFURERGZOLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4/c11-10(14-9-1-2-9)13-7-8-3-5-12-6-4-8/h3-6,9H,1-2,7H2,(H3,11,13,14).
What are the key properties of 1-cyclopropyl-2-(pyridin-4-ylmethyl)guanidine?
1-cyclopropyl-2-(pyridin-4-ylmethyl)guanidine has a molecular weight of 190.25 g/mol, XLogP of 0.65, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-(pyridin-4-ylmethyl)guanidine is sourced from PubChem (CID 62362184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).