2-cyclopropyl-1-methyl-1-(1-methylpiperidin-4-yl)guanidine

C11H22N4 — CID 62360654

IUPAC2-cyclopropyl-1-methyl-1-(1-methylpiperidin-4-yl)guanidine
SMILESCN1CCC(N(C)/C(N)=N/C2CC2)CC1
InChIInChI=1S/C11H22N4/c1-14-7-5-10(6-8-14)15(2)11(12)13-9-3-4-9/h9-10H,3-8H2,1-2H3,(H2,12,13)
InChIKeyGHCPUCUJKFXHAV-UHFFFAOYSA-N
MW210.32 g/mol
LogP0.49
Rot. Bonds2

About 2-cyclopropyl-1-methyl-1-(1-methylpiperidin-4-yl)guanidine

2-cyclopropyl-1-methyl-1-(1-methylpiperidin-4-yl)guanidine (PubChem CID 62360654) has the molecular formula C11H22N4 and a molecular weight of 210.32 g/mol. Its IUPAC name is 2-cyclopropyl-1-methyl-1-(1-methylpiperidin-4-yl)guanidine.

Molecular Properties

Compound Name2-cyclopropyl-1-methyl-1-(1-methylpiperidin-4-yl)guanidine
PubChem CID62360654
Molecular FormulaC11H22N4
Molecular Weight210.32 g/mol
Exact Mass210.18
IUPAC Name2-cyclopropyl-1-methyl-1-(1-methylpiperidin-4-yl)guanidine
SMILESCN1CCC(N(C)/C(N)=N/C2CC2)CC1
InChIInChI=1S/C11H22N4/c1-14-7-5-10(6-8-14)15(2)11(12)13-9-3-4-9/h9-10H,3-8H2,1-2H3,(H2,12,13)
InChIKeyGHCPUCUJKFXHAV-UHFFFAOYSA-N
XLogP0.49
TPSA44.86 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 50.49
H-Bond Donors ≤ 51
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

2-cyclopentyl-1-methyl-1-(1-methylpiperidin-4-yl)guanidine
CID 55063864
1,2-dicyclopropyl-1-methylguanidine
CID 62359014
2-cyclopropyl-1-methyl-1-(oxolan-3-yl)guanidine
CID 78967151
1-cyclopropyl-1-methyl-2-[2-(1-methylpiperidin-4-yl)ethyl]guanidine
CID 110030671
tert-butyl 4-[[amino-[cyclopropyl(methyl)amino]methylidene]amino]cyclohexane-1-carboxylate
CID 110031868
1-methyl-1-(1-methylpiperidin-4-yl)guanidine
CID 43189380
1-cyclopropyl-1-methyl-2-(3-propan-2-yloxycyclobutyl)guanidine
CID 122098510
2-cyclopropyl-1-methyl-1-(2-methylcyclohexyl)guanidine
CID 62364792
N-(1-methylpiperidin-4-yl)propan-2-imine
CID 123600860
2-(4-aminocyclohexyl)-1,1-dimethylguanidine
CID 58655487
4-amino-N-methyl-N-(1-methylpiperidin-4-yl)butanamide
CID 60731508
2-amino-1-cyclopropyl-1-methylguanidine;hydroiodide
CID 87258181

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-methyl-1-(1-methylpiperidin-4-yl)guanidine?
The IUPAC name of 2-cyclopropyl-1-methyl-1-(1-methylpiperidin-4-yl)guanidine (CID 62360654) is 2-cyclopropyl-1-methyl-1-(1-methylpiperidin-4-yl)guanidine.
What is the SMILES notation for 2-cyclopropyl-1-methyl-1-(1-methylpiperidin-4-yl)guanidine?
The canonical SMILES for 2-cyclopropyl-1-methyl-1-(1-methylpiperidin-4-yl)guanidine is CN1CCC(N(C)/C(N)=N/C2CC2)CC1.
What is the InChIKey of 2-cyclopropyl-1-methyl-1-(1-methylpiperidin-4-yl)guanidine?
The InChIKey is GHCPUCUJKFXHAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4/c1-14-7-5-10(6-8-14)15(2)11(12)13-9-3-4-9/h9-10H,3-8H2,1-2H3,(H2,12,13).
What are the key properties of 2-cyclopropyl-1-methyl-1-(1-methylpiperidin-4-yl)guanidine?
2-cyclopropyl-1-methyl-1-(1-methylpiperidin-4-yl)guanidine has a molecular weight of 210.32 g/mol, XLogP of 0.49, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-methyl-1-(1-methylpiperidin-4-yl)guanidine is sourced from PubChem (CID 62360654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).