N',3,5-trimethyl-N-(2-methylcyclopropyl)piperidine-1-carboximidamide

C13H25N3 — CID 111153377

IUPACN',3,5-trimethyl-N-(2-methylcyclopropyl)piperidine-1-carboximidamide
SMILESC/N=C(/NC1CC1C)N1CC(C)CC(C)C1
InChIInChI=1S/C13H25N3/c1-9-5-10(2)8-16(7-9)13(14-4)15-12-6-11(12)3/h9-12H,5-8H2,1-4H3,(H,14,15)
InChIKeyRWAPGUZPGCFZDO-UHFFFAOYSA-N
MW223.36 g/mol
LogP1.95
Rot. Bonds1

About N',3,5-trimethyl-N-(2-methylcyclopropyl)piperidine-1-carboximidamide

N',3,5-trimethyl-N-(2-methylcyclopropyl)piperidine-1-carboximidamide (PubChem CID 111153377) has the molecular formula C13H25N3 and a molecular weight of 223.36 g/mol. Its IUPAC name is N',3,5-trimethyl-N-(2-methylcyclopropyl)piperidine-1-carboximidamide.

Molecular Properties

Compound NameN',3,5-trimethyl-N-(2-methylcyclopropyl)piperidine-1-carboximidamide
PubChem CID111153377
Molecular FormulaC13H25N3
Molecular Weight223.36 g/mol
Exact Mass223.20
IUPAC NameN',3,5-trimethyl-N-(2-methylcyclopropyl)piperidine-1-carboximidamide
SMILESC/N=C(/NC1CC1C)N1CC(C)CC(C)C1
InChIInChI=1S/C13H25N3/c1-9-5-10(2)8-16(7-9)13(14-4)15-12-6-11(12)3/h9-12H,5-8H2,1-4H3,(H,14,15)
InChIKeyRWAPGUZPGCFZDO-UHFFFAOYSA-N
XLogP1.95
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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

N,N'-di(propan-2-yl)piperidine-1-carboximidamide
CID 14423432
1-piperidin-1-ium-1-ylidene-N,N'-di(propan-2-yl)methanediamine
CID 101490813
N'-methyl-N-(2-propylcyclopropyl)-4-(1,1,1-trifluoropropan-2-yl)piperazine-1-carboximidamide;hydroiodide
CID 109376058
N'-methyl-N-(2-propylcyclopropyl)-4-(1,1,1-trifluoropropan-2-yl)piperazine-1-carboximidamide
CID 109376059
N-(3-cyclopropylpropyl)-N'-methyl-4-(1,1,1-trifluoropropan-2-yl)piperazine-1-carboximidamide;hydroiodide
CID 109376074
N-(3-cyclopropylpropyl)-N'-methyl-4-(1,1,1-trifluoropropan-2-yl)piperazine-1-carboximidamide
CID 109376075
N-(2-cyclopropylethyl)-N'-methyl-4-(1,1,1-trifluoropropan-2-yl)piperazine-1-carboximidamide
CID 109376543
N'-ethyl-N-(2-propylcyclopropyl)-4-(1,1,1-trifluoropropan-2-yl)piperazine-1-carboximidamide
CID 109376773
2-Methyl-1-[(1-propan-2-ylpiperidin-3-yl)methyl]-3-(3,3,3-trifluoropropyl)guanidine
CID 109473455
1-Ethyl-2-[(1-propan-2-ylpiperidin-3-yl)methyl]-3-(3,3,3-trifluoropropyl)guanidine
CID 109474849
1-Cyclopropyl-2-methyl-3-[2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]guanidine;hydroiodide
CID 111752908
1-Cyclopropyl-2-methyl-3-[2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]guanidine
CID 111752909

Frequently Asked Questions

What is the IUPAC name of N',3,5-trimethyl-N-(2-methylcyclopropyl)piperidine-1-carboximidamide?
The IUPAC name of N',3,5-trimethyl-N-(2-methylcyclopropyl)piperidine-1-carboximidamide (CID 111153377) is N',3,5-trimethyl-N-(2-methylcyclopropyl)piperidine-1-carboximidamide.
What is the SMILES notation for N',3,5-trimethyl-N-(2-methylcyclopropyl)piperidine-1-carboximidamide?
The canonical SMILES for N',3,5-trimethyl-N-(2-methylcyclopropyl)piperidine-1-carboximidamide is C/N=C(/NC1CC1C)N1CC(C)CC(C)C1.
What is the InChIKey of N',3,5-trimethyl-N-(2-methylcyclopropyl)piperidine-1-carboximidamide?
The InChIKey is RWAPGUZPGCFZDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3/c1-9-5-10(2)8-16(7-9)13(14-4)15-12-6-11(12)3/h9-12H,5-8H2,1-4H3,(H,14,15).
What are the key properties of N',3,5-trimethyl-N-(2-methylcyclopropyl)piperidine-1-carboximidamide?
N',3,5-trimethyl-N-(2-methylcyclopropyl)piperidine-1-carboximidamide has a molecular weight of 223.36 g/mol, XLogP of 1.95, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N',3,5-trimethyl-N-(2-methylcyclopropyl)piperidine-1-carboximidamide is sourced from PubChem (CID 111153377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).