N,N',4-trimethylpiperidine-1-carboximidamide

C9H19N3 — CID 59874915

IUPACN,N',4-trimethylpiperidine-1-carboximidamide
SMILESC/N=C(\NC)N1CCC(C)CC1
InChIInChI=1S/C9H19N3/c1-8-4-6-12(7-5-8)9(10-2)11-3/h8H,4-7H2,1-3H3,(H,10,11)
InChIKeyNNOIRDRKBPWBML-UHFFFAOYSA-N
MW169.27 g/mol
LogP0.92
Rot. Bonds

About N,N',4-trimethylpiperidine-1-carboximidamide

N,N',4-trimethylpiperidine-1-carboximidamide (PubChem CID 59874915) has the molecular formula C9H19N3 and a molecular weight of 169.27 g/mol. Its IUPAC name is N,N',4-trimethylpiperidine-1-carboximidamide.

Molecular Properties

Compound NameN,N',4-trimethylpiperidine-1-carboximidamide
PubChem CID59874915
Molecular FormulaC9H19N3
Molecular Weight169.27 g/mol
Exact Mass169.16
IUPAC NameN,N',4-trimethylpiperidine-1-carboximidamide
SMILESC/N=C(\NC)N1CCC(C)CC1
InChIInChI=1S/C9H19N3/c1-8-4-6-12(7-5-8)9(10-2)11-3/h8H,4-7H2,1-3H3,(H,10,11)
InChIKeyNNOIRDRKBPWBML-UHFFFAOYSA-N
XLogP0.92
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 50.92
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
3,3,7,7-tetraethyl-4,6,8,9-tetrahydro-2H-pyrimido[1,2-a]pyrimidine
CID 101417808
1-piperidin-1-ium-1-ylidene-N,N'-di(propan-2-yl)methanediamine
CID 101490813
N'-propyl-4-(trifluoromethyl)piperidine-1-carboximidamide
CID 65536343
N'-ethyl-4-(trifluoromethyl)piperidine-1-carboximidamide
CID 65539039
N'-(2-methylpropyl)-4-(trifluoromethyl)piperidine-1-carboximidamide
CID 65539230
4-methyl-N'-(3,3,3-trifluoropropyl)piperidine-1-carboximidamide
CID 91659422
1-Ethyl-2-[2-(1-methylpiperidin-4-yl)ethyl]-3-(3,3,3-trifluoropropyl)guanidine;hydroiodide
CID 109471716
1-Ethyl-2-[2-(1-methylpiperidin-4-yl)ethyl]-3-(3,3,3-trifluoropropyl)guanidine
CID 109471717
2-Methyl-1-[2-(4-methylpiperidin-1-yl)ethyl]-3-(3,3,3-trifluoropropyl)guanidine
CID 109472263
1-Ethyl-3-[2-(4-methylpiperidin-1-yl)ethyl]-2-(3,3,3-trifluoropropyl)guanidine
CID 109472265
2-Methyl-1-[2-(1-methylpiperidin-4-yl)ethyl]-3-(3,3,3-trifluoropropyl)guanidine;hydroiodide
CID 109472310

Frequently Asked Questions

What is the IUPAC name of N,N',4-trimethylpiperidine-1-carboximidamide?
The IUPAC name of N,N',4-trimethylpiperidine-1-carboximidamide (CID 59874915) is N,N',4-trimethylpiperidine-1-carboximidamide.
What is the SMILES notation for N,N',4-trimethylpiperidine-1-carboximidamide?
The canonical SMILES for N,N',4-trimethylpiperidine-1-carboximidamide is C/N=C(\NC)N1CCC(C)CC1.
What is the InChIKey of N,N',4-trimethylpiperidine-1-carboximidamide?
The InChIKey is NNOIRDRKBPWBML-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3/c1-8-4-6-12(7-5-8)9(10-2)11-3/h8H,4-7H2,1-3H3,(H,10,11).
What are the key properties of N,N',4-trimethylpiperidine-1-carboximidamide?
N,N',4-trimethylpiperidine-1-carboximidamide has a molecular weight of 169.27 g/mol, XLogP of 0.92, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N',4-trimethylpiperidine-1-carboximidamide is sourced from PubChem (CID 59874915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).