1-cyclopropyl-2-(1,3-dimethylpiperidin-4-yl)guanidine

C11H22N4 — CID 115600959

IUPAC1-cyclopropyl-2-(1,3-dimethylpiperidin-4-yl)guanidine
SMILESCC1CN(C)CCC1/N=C(\N)NC1CC1
InChIInChI=1S/C11H22N4/c1-8-7-15(2)6-5-10(8)14-11(12)13-9-3-4-9/h8-10H,3-7H2,1-2H3,(H3,12,13,14)
InChIKeyZJEOFGXLOBOHLC-UHFFFAOYSA-N
MW210.32 g/mol
LogP0.39
Rot. Bonds2

About 1-cyclopropyl-2-(1,3-dimethylpiperidin-4-yl)guanidine

1-cyclopropyl-2-(1,3-dimethylpiperidin-4-yl)guanidine (PubChem CID 115600959) has the molecular formula C11H22N4 and a molecular weight of 210.32 g/mol. Its IUPAC name is 1-cyclopropyl-2-(1,3-dimethylpiperidin-4-yl)guanidine.

Molecular Properties

Compound Name1-cyclopropyl-2-(1,3-dimethylpiperidin-4-yl)guanidine
PubChem CID115600959
Molecular FormulaC11H22N4
Molecular Weight210.32 g/mol
Exact Mass210.18
IUPAC Name1-cyclopropyl-2-(1,3-dimethylpiperidin-4-yl)guanidine
SMILESCC1CN(C)CCC1/N=C(\N)NC1CC1
InChIInChI=1S/C11H22N4/c1-8-7-15(2)6-5-10(8)14-11(12)13-9-3-4-9/h8-10H,3-7H2,1-2H3,(H3,12,13,14)
InChIKeyZJEOFGXLOBOHLC-UHFFFAOYSA-N
XLogP0.39
TPSA53.65 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 50.39
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-cyclopropyl-2-(2,3-dimethylcyclobutyl)guanidine
CID 130993715
1-cyclopropyl-2-(3-methyloxan-4-yl)guanidine
CID 130491764
1-cyclopropyl-3-(1,3-dimethylpiperidin-4-yl)thiourea
CID 115598623
1-(1-methylpyrrolidin-3-yl)-2-propylguanidine
CID 62363794
1-cyclopropyl-2-[(1,4-dimethylpiperazin-2-yl)methyl]guanidine;hydroiodide
CID 119147592
1-cyclopropyl-2-(1-methyl-2-oxopyrrolidin-3-yl)guanidine
CID 106257207
1-amino-3-(1,3-dimethylpiperidin-4-yl)-2-methylguanidine
CID 104931189
trans-(1S,2S)-2-methyl-N-(1-methylpyrrolidin-3-yl)cyclopropane-1-carboxamide
CID 131019581
4-[(1,3-dimethylpiperidin-4-yl)carbamoylamino]cyclohexane-1-carboxylic acid
CID 114505373
1-cyclopropyl-2-[(2-methylcyclopropyl)methyl]guanidine
CID 115600994
2-[(1,3-dimethylpiperidin-4-yl)amino]ethanol
CID 115707421
(3S,4R)-1,3,4-trimethylpiperidine
CID 14454424

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-(1,3-dimethylpiperidin-4-yl)guanidine?
The IUPAC name of 1-cyclopropyl-2-(1,3-dimethylpiperidin-4-yl)guanidine (CID 115600959) is 1-cyclopropyl-2-(1,3-dimethylpiperidin-4-yl)guanidine.
What is the SMILES notation for 1-cyclopropyl-2-(1,3-dimethylpiperidin-4-yl)guanidine?
The canonical SMILES for 1-cyclopropyl-2-(1,3-dimethylpiperidin-4-yl)guanidine is CC1CN(C)CCC1/N=C(\N)NC1CC1.
What is the InChIKey of 1-cyclopropyl-2-(1,3-dimethylpiperidin-4-yl)guanidine?
The InChIKey is ZJEOFGXLOBOHLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4/c1-8-7-15(2)6-5-10(8)14-11(12)13-9-3-4-9/h8-10H,3-7H2,1-2H3,(H3,12,13,14).
What are the key properties of 1-cyclopropyl-2-(1,3-dimethylpiperidin-4-yl)guanidine?
1-cyclopropyl-2-(1,3-dimethylpiperidin-4-yl)guanidine has a molecular weight of 210.32 g/mol, XLogP of 0.39, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-(1,3-dimethylpiperidin-4-yl)guanidine is sourced from PubChem (CID 115600959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).