N'-amino-4-propan-2-ylpiperidine-1-carboximidamide

C9H20N4 — CID 103497019

IUPACN'-amino-4-propan-2-ylpiperidine-1-carboximidamide
SMILESCC(C)C1CCN(C(N)=NN)CC1
InChIInChI=1S/C9H20N4/c1-7(2)8-3-5-13(6-4-8)9(10)12-11/h7-8H,3-6,11H2,1-2H3,(H2,10,12)
InChIKeyAYYMPYSFIKPQFX-UHFFFAOYSA-N
MW184.29 g/mol
LogP0.54
Rot. Bonds1

About N'-amino-4-propan-2-ylpiperidine-1-carboximidamide

N'-amino-4-propan-2-ylpiperidine-1-carboximidamide (PubChem CID 103497019) has the molecular formula C9H20N4 and a molecular weight of 184.29 g/mol. Its IUPAC name is N'-amino-4-propan-2-ylpiperidine-1-carboximidamide.

Molecular Properties

Compound NameN'-amino-4-propan-2-ylpiperidine-1-carboximidamide
PubChem CID103497019
Molecular FormulaC9H20N4
Molecular Weight184.29 g/mol
Exact Mass184.17
IUPAC NameN'-amino-4-propan-2-ylpiperidine-1-carboximidamide
SMILESCC(C)C1CCN(C(N)=NN)CC1
InChIInChI=1S/C9H20N4/c1-7(2)8-3-5-13(6-4-8)9(10)12-11/h7-8H,3-6,11H2,1-2H3,(H2,10,12)
InChIKeyAYYMPYSFIKPQFX-UHFFFAOYSA-N
XLogP0.54
TPSA67.64 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.29
LogP ≤ 50.54
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-4-hydroxypiperidine-1-carboximidamide
CID 77054111
N'-pentan-2-yl-4-propan-2-ylpiperidine-1-carboximidamide
CID 134399763
N'-amino-4-(methoxymethyl)piperidine-1-carboximidamide
CID 77054109
N'-aminoazetidine-1-carboximidamide
CID 77052778
1-(4-propan-2-ylpiperidin-1-yl)ethanone
CID 12791779
N'-benzyl-3-propan-2-ylpyrrolidine-1-carboximidamide
CID 130557165
N'-hydroxy-3-oxo-3-(4-propan-2-ylpiperidin-1-yl)propanimidamide
CID 103501053
N'-amino-4-ethyl-4-methylpiperidine-1-carboximidamide
CID 77054107
N,N-dimethyl-4-propan-2-ylpiperidine-1-carboxamide
CID 58688988
N'-amino-4-tert-butylpiperazine-1-carboximidamide
CID 77053990
4-(hydroxymethyl)-N'-propan-2-ylpiperidine-1-carboximidamide
CID 62367974
2-amino-1-(3-propan-2-ylpyrrolidin-1-yl)propan-1-one
CID 115734771

Frequently Asked Questions

What is the IUPAC name of N'-amino-4-propan-2-ylpiperidine-1-carboximidamide?
The IUPAC name of N'-amino-4-propan-2-ylpiperidine-1-carboximidamide (CID 103497019) is N'-amino-4-propan-2-ylpiperidine-1-carboximidamide.
What is the SMILES notation for N'-amino-4-propan-2-ylpiperidine-1-carboximidamide?
The canonical SMILES for N'-amino-4-propan-2-ylpiperidine-1-carboximidamide is CC(C)C1CCN(C(N)=NN)CC1.
What is the InChIKey of N'-amino-4-propan-2-ylpiperidine-1-carboximidamide?
The InChIKey is AYYMPYSFIKPQFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N4/c1-7(2)8-3-5-13(6-4-8)9(10)12-11/h7-8H,3-6,11H2,1-2H3,(H2,10,12).
What are the key properties of N'-amino-4-propan-2-ylpiperidine-1-carboximidamide?
N'-amino-4-propan-2-ylpiperidine-1-carboximidamide has a molecular weight of 184.29 g/mol, XLogP of 0.54, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-amino-4-propan-2-ylpiperidine-1-carboximidamide is sourced from PubChem (CID 103497019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).