N-amino-3,3-dimethyl-N'-(2-methylpropyl)piperidine-1-carboximidamide

C12H26N4 — CID 104886315

IUPACN-amino-3,3-dimethyl-N'-(2-methylpropyl)piperidine-1-carboximidamide
SMILESCC(C)C/N=C(\NN)N1CCCC(C)(C)C1
InChIInChI=1S/C12H26N4/c1-10(2)8-14-11(15-13)16-7-5-6-12(3,4)9-16/h10H,5-9,13H2,1-4H3,(H,14,15)
InChIKeyFMVYNRYZEPVGPB-UHFFFAOYSA-N
MW226.37 g/mol
LogP1.58
Rot. Bonds2

About N-amino-3,3-dimethyl-N'-(2-methylpropyl)piperidine-1-carboximidamide

N-amino-3,3-dimethyl-N'-(2-methylpropyl)piperidine-1-carboximidamide (PubChem CID 104886315) has the molecular formula C12H26N4 and a molecular weight of 226.37 g/mol. Its IUPAC name is N-amino-3,3-dimethyl-N'-(2-methylpropyl)piperidine-1-carboximidamide.

Molecular Properties

Compound NameN-amino-3,3-dimethyl-N'-(2-methylpropyl)piperidine-1-carboximidamide
PubChem CID104886315
Molecular FormulaC12H26N4
Molecular Weight226.37 g/mol
Exact Mass226.22
IUPAC NameN-amino-3,3-dimethyl-N'-(2-methylpropyl)piperidine-1-carboximidamide
SMILESCC(C)C/N=C(\NN)N1CCCC(C)(C)C1
InChIInChI=1S/C12H26N4/c1-10(2)8-14-11(15-13)16-7-5-6-12(3,4)9-16/h10H,5-9,13H2,1-4H3,(H,14,15)
InChIKeyFMVYNRYZEPVGPB-UHFFFAOYSA-N
XLogP1.58
TPSA53.65 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.37
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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

N-amino-3,3,4-trimethyl-N'-(2-methylpropyl)piperazine-1-carboximidamide
CID 104886298
N-amino-N'-(2-methylpropyl)-1,4-thiazepane-4-carboximidamide
CID 104885614
N-amino-4-tert-butyl-N'-(2-methylpropyl)piperazine-1-carboximidamide
CID 104885333
N-ethyl-N'-(2-methylpropyl)-2-azaspiro[4.4]nonane-2-carboximidamide
CID 111733329
1-(3,3-dimethylpiperidin-1-yl)-3-methylbutan-1-one
CID 58688971
3,3-dimethyl-N-(2-methylpropyl)piperidine-1-carbothioamide
CID 115623852
N-amino-4-tert-butyl-N'-(2-methylpropyl)piperidine-1-carboximidamide
CID 104884230
N-amino-3,4-dimethyl-N'-(2-methylpropyl)piperidine-1-carboximidamide
CID 104888959
N'-hydroxy-3,3-dimethylpiperidine-1-carboximidamide
CID 77016547
1-amino-3-(1-methylcyclobutyl)-2-(2-methylpropyl)guanidine
CID 104888487
N-amino-4-benzyl-N'-(2-methylpropyl)piperazine-1-carboximidamide
CID 116512908
(2S)-2-[(3,3-dimethylpiperidine-1-carbonyl)amino]-4-methylpentanoic acid
CID 78956516

Frequently Asked Questions

What is the IUPAC name of N-amino-3,3-dimethyl-N'-(2-methylpropyl)piperidine-1-carboximidamide?
The IUPAC name of N-amino-3,3-dimethyl-N'-(2-methylpropyl)piperidine-1-carboximidamide (CID 104886315) is N-amino-3,3-dimethyl-N'-(2-methylpropyl)piperidine-1-carboximidamide.
What is the SMILES notation for N-amino-3,3-dimethyl-N'-(2-methylpropyl)piperidine-1-carboximidamide?
The canonical SMILES for N-amino-3,3-dimethyl-N'-(2-methylpropyl)piperidine-1-carboximidamide is CC(C)C/N=C(\NN)N1CCCC(C)(C)C1.
What is the InChIKey of N-amino-3,3-dimethyl-N'-(2-methylpropyl)piperidine-1-carboximidamide?
The InChIKey is FMVYNRYZEPVGPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N4/c1-10(2)8-14-11(15-13)16-7-5-6-12(3,4)9-16/h10H,5-9,13H2,1-4H3,(H,14,15).
What are the key properties of N-amino-3,3-dimethyl-N'-(2-methylpropyl)piperidine-1-carboximidamide?
N-amino-3,3-dimethyl-N'-(2-methylpropyl)piperidine-1-carboximidamide has a molecular weight of 226.37 g/mol, XLogP of 1.58, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-3,3-dimethyl-N'-(2-methylpropyl)piperidine-1-carboximidamide is sourced from PubChem (CID 104886315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).