N'-cyclopentyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboximidamide

C14H26N4 — CID 79934866

IUPACN'-cyclopentyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboximidamide
SMILESN/C(=N\C1CCCC1)N1CCN2CCCCC2C1
InChIInChI=1S/C14H26N4/c15-14(16-12-5-1-2-6-12)18-10-9-17-8-4-3-7-13(17)11-18/h12-13H,1-11H2,(H2,15,16)
InChIKeyCSUZUQDTZVVDIK-UHFFFAOYSA-N
MW250.39 g/mol
LogP1.41
Rot. Bonds1

About N'-cyclopentyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboximidamide

N'-cyclopentyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboximidamide (PubChem CID 79934866) has the molecular formula C14H26N4 and a molecular weight of 250.39 g/mol. Its IUPAC name is N'-cyclopentyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboximidamide.

Molecular Properties

Compound NameN'-cyclopentyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboximidamide
PubChem CID79934866
Molecular FormulaC14H26N4
Molecular Weight250.39 g/mol
Exact Mass250.22
IUPAC NameN'-cyclopentyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboximidamide
SMILESN/C(=N\C1CCCC1)N1CCN2CCCCC2C1
InChIInChI=1S/C14H26N4/c15-14(16-12-5-1-2-6-12)18-10-9-17-8-4-3-7-13(17)11-18/h12-13H,1-11H2,(H2,15,16)
InChIKeyCSUZUQDTZVVDIK-UHFFFAOYSA-N
XLogP1.41
TPSA44.86 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 51.41
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

N'-cyclohexyl-4-cyclopentylpiperazine-1-carboximidamide
CID 62369969
1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboxamide
CID 78942270
N',4-dicyclopropylpiperazine-1-carboximidamide
CID 62363225
3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide
CID 79937848
1-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carbonyl)-N'-hydroxycyclobutane-1-carboximidamide
CID 80594478
N'-cyclopentyl-4-ethyl-3-methylpiperazine-1-carboximidamide
CID 63620899
2-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-2-oxoacetaldehyde
CID 116999426
(2-aminocyclopropyl)-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)methanone
CID 114994976
(3-aminocyclobutyl)-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)methanone
CID 116999420
N-amino-N'-ethyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboximidamide
CID 104887396
4-methyl-N'-(3-piperidin-1-ylcyclobutyl)piperidine-1-carboximidamide
CID 120655351
1-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-2-sulfanylethanone
CID 79925171

Frequently Asked Questions

What is the IUPAC name of N'-cyclopentyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboximidamide?
The IUPAC name of N'-cyclopentyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboximidamide (CID 79934866) is N'-cyclopentyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboximidamide.
What is the SMILES notation for N'-cyclopentyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboximidamide?
The canonical SMILES for N'-cyclopentyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboximidamide is N/C(=N\C1CCCC1)N1CCN2CCCCC2C1.
What is the InChIKey of N'-cyclopentyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboximidamide?
The InChIKey is CSUZUQDTZVVDIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4/c15-14(16-12-5-1-2-6-12)18-10-9-17-8-4-3-7-13(17)11-18/h12-13H,1-11H2,(H2,15,16).
What are the key properties of N'-cyclopentyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboximidamide?
N'-cyclopentyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboximidamide has a molecular weight of 250.39 g/mol, XLogP of 1.41, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopentyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboximidamide is sourced from PubChem (CID 79934866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).