1-amino-2-cyclopropyl-3-(4-methyl-3-pyridinyl)guanidine

C10H15N5 — CID 116515203

IUPAC1-amino-2-cyclopropyl-3-(4-methyl-3-pyridinyl)guanidine
SMILESCc1ccncc1N/C(=N/C1CC1)NN
InChIInChI=1S/C10H15N5/c1-7-4-5-12-6-9(7)14-10(15-11)13-8-2-3-8/h4-6,8H,2-3,11H2,1H3,(H2,13,14,15)
InChIKeyLKFPBASXCNKRLN-UHFFFAOYSA-N
MW205.26 g/mol
LogP0.78
Rot. Bonds2

About 1-amino-2-cyclopropyl-3-(4-methyl-3-pyridinyl)guanidine

1-amino-2-cyclopropyl-3-(4-methyl-3-pyridinyl)guanidine (PubChem CID 116515203) has the molecular formula C10H15N5 and a molecular weight of 205.26 g/mol. Its IUPAC name is 1-amino-2-cyclopropyl-3-(4-methyl-3-pyridinyl)guanidine.

Molecular Properties

Compound Name1-amino-2-cyclopropyl-3-(4-methyl-3-pyridinyl)guanidine
PubChem CID116515203
Molecular FormulaC10H15N5
Molecular Weight205.26 g/mol
Exact Mass205.13
IUPAC Name1-amino-2-cyclopropyl-3-(4-methyl-3-pyridinyl)guanidine
SMILESCc1ccncc1N/C(=N/C1CC1)NN
InChIInChI=1S/C10H15N5/c1-7-4-5-12-6-9(7)14-10(15-11)13-8-2-3-8/h4-6,8H,2-3,11H2,1H3,(H2,13,14,15)
InChIKeyLKFPBASXCNKRLN-UHFFFAOYSA-N
XLogP0.78
TPSA75.33 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 50.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-amino-2-cyclohexyl-3-(4-methyl-3-pyridinyl)guanidine
CID 116515198
1-amino-2-cyclopropyl-3-isoquinolin-8-ylguanidine
CID 116515928
1-amino-3-(5-bromo-2-methylphenyl)-2-cyclopropylguanidine
CID 116513464
1-amino-3-(4-methyl-3-pyridinyl)-2-propylguanidine
CID 116515197
1-cyclopropyl-3-(4-methyl-3-pyridinyl)thiourea
CID 115612151
1-amino-2-cyclohexyl-3-(4-fluoro-2-methylphenyl)guanidine
CID 116512508
1-amino-3-(2-chloro-6-methylphenyl)-2-cyclopropylguanidine
CID 116515719
1,3-bis(4-methyl-3-pyridinyl)urea
CID 86818735
1-amino-2-cyclopentyl-3-(2,5-dichloro-4-methylphenyl)guanidine
CID 116516391
2-bromo-N-(4-methyl-3-pyridinyl)acetamide
CID 63678424
3-cyclopropyl-N-(4-methyl-3-pyridinyl)cyclobutane-1-carboxamide
CID 154866117
1-amino-2-cyclohexyl-3-(2-methoxy-5-methylphenyl)guanidine
CID 116512151

Frequently Asked Questions

What is the IUPAC name of 1-amino-2-cyclopropyl-3-(4-methyl-3-pyridinyl)guanidine?
The IUPAC name of 1-amino-2-cyclopropyl-3-(4-methyl-3-pyridinyl)guanidine (CID 116515203) is 1-amino-2-cyclopropyl-3-(4-methyl-3-pyridinyl)guanidine.
What is the SMILES notation for 1-amino-2-cyclopropyl-3-(4-methyl-3-pyridinyl)guanidine?
The canonical SMILES for 1-amino-2-cyclopropyl-3-(4-methyl-3-pyridinyl)guanidine is Cc1ccncc1N/C(=N/C1CC1)NN.
What is the InChIKey of 1-amino-2-cyclopropyl-3-(4-methyl-3-pyridinyl)guanidine?
The InChIKey is LKFPBASXCNKRLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5/c1-7-4-5-12-6-9(7)14-10(15-11)13-8-2-3-8/h4-6,8H,2-3,11H2,1H3,(H2,13,14,15).
What are the key properties of 1-amino-2-cyclopropyl-3-(4-methyl-3-pyridinyl)guanidine?
1-amino-2-cyclopropyl-3-(4-methyl-3-pyridinyl)guanidine has a molecular weight of 205.26 g/mol, XLogP of 0.78, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2-cyclopropyl-3-(4-methyl-3-pyridinyl)guanidine is sourced from PubChem (CID 116515203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).