1-amino-2-cyclopropyl-3-(dimethylamino)guanidine

C6H15N5 — CID 104887916

IUPAC1-amino-2-cyclopropyl-3-(dimethylamino)guanidine
SMILESCN(C)N/C(=N/C1CC1)NN
InChIInChI=1S/C6H15N5/c1-11(2)10-6(9-7)8-5-3-4-5/h5H,3-4,7H2,1-2H3,(H2,8,9,10)
InChIKeyIDLLLVQORZCINR-UHFFFAOYSA-N
MW157.22 g/mol
LogP-0.97
Rot. Bonds2

About 1-amino-2-cyclopropyl-3-(dimethylamino)guanidine

1-amino-2-cyclopropyl-3-(dimethylamino)guanidine (PubChem CID 104887916) has the molecular formula C6H15N5 and a molecular weight of 157.22 g/mol. Its IUPAC name is 1-amino-2-cyclopropyl-3-(dimethylamino)guanidine.

Molecular Properties

Compound Name1-amino-2-cyclopropyl-3-(dimethylamino)guanidine
PubChem CID104887916
Molecular FormulaC6H15N5
Molecular Weight157.22 g/mol
Exact Mass157.13
IUPAC Name1-amino-2-cyclopropyl-3-(dimethylamino)guanidine
SMILESCN(C)N/C(=N/C1CC1)NN
InChIInChI=1S/C6H15N5/c1-11(2)10-6(9-7)8-5-3-4-5/h5H,3-4,7H2,1-2H3,(H2,8,9,10)
InChIKeyIDLLLVQORZCINR-UHFFFAOYSA-N
XLogP-0.97
TPSA65.68 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.22
LogP ≤ 5-0.97
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-3-cyclopropyl-2-(4-methylcyclohexyl)guanidine
CID 104883140
2-[(N-amino-N'-cyclopropylcarbamimidoyl)amino]-2-methylpropanamide
CID 104885512
1-amino-2-cyclopropyl-3-(5-methylhexan-2-yl)guanidine
CID 104886508
1-amino-2-cyclopropyl-3-(1,1-dioxothietan-3-yl)guanidine
CID 130820208
3-amino-2-cyclohexyl-1,1-dimethylguanidine
CID 104883392
1-amino-2-cyclopropyl-3-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)guanidine
CID 104886579
1-amino-3-cyclobutyl-2-cyclohexylguanidine
CID 104882648
3-amino-1-(cyclopentylmethyl)-2-cyclopropyl-1-methylguanidine
CID 104886066
1-amino-2-cyclopropyl-3-(4-ethylsulfanylbutan-2-yl)guanidine
CID 104889027
3-amino-2-cyclopentyl-1-cyclopropyl-1-methylguanidine
CID 104883533
1-amino-2-cyclopropyl-3-(3-methyl-1,1-dioxothiolan-3-yl)guanidine
CID 104884953
2-cyclopropyl-1,1-dipropylguanidine
CID 62359563

Frequently Asked Questions

What is the IUPAC name of 1-amino-2-cyclopropyl-3-(dimethylamino)guanidine?
The IUPAC name of 1-amino-2-cyclopropyl-3-(dimethylamino)guanidine (CID 104887916) is 1-amino-2-cyclopropyl-3-(dimethylamino)guanidine.
What is the SMILES notation for 1-amino-2-cyclopropyl-3-(dimethylamino)guanidine?
The canonical SMILES for 1-amino-2-cyclopropyl-3-(dimethylamino)guanidine is CN(C)N/C(=N/C1CC1)NN.
What is the InChIKey of 1-amino-2-cyclopropyl-3-(dimethylamino)guanidine?
The InChIKey is IDLLLVQORZCINR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15N5/c1-11(2)10-6(9-7)8-5-3-4-5/h5H,3-4,7H2,1-2H3,(H2,8,9,10).
What are the key properties of 1-amino-2-cyclopropyl-3-(dimethylamino)guanidine?
1-amino-2-cyclopropyl-3-(dimethylamino)guanidine has a molecular weight of 157.22 g/mol, XLogP of -0.97, 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-(dimethylamino)guanidine is sourced from PubChem (CID 104887916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).