3-(4-piperidin-1-ylpiperidin-1-yl)pentanimidamide

C15H30N4 — CID 61242438

IUPAC3-(4-piperidin-1-ylpiperidin-1-yl)pentanimidamide
SMILES[H]/N=C(\N)CC(CC)N1CCC(N2CCCCC2)CC1
InChIInChI=1S/C15H30N4/c1-2-13(12-15(16)17)19-10-6-14(7-11-19)18-8-4-3-5-9-18/h13-14H,2-12H2,1H3,(H3,16,17)
InChIKeyWFGCMXPQFDYDSP-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.04
Rot. Bonds5

About 3-(4-piperidin-1-ylpiperidin-1-yl)pentanimidamide

3-(4-piperidin-1-ylpiperidin-1-yl)pentanimidamide (PubChem CID 61242438) has the molecular formula C15H30N4 and a molecular weight of 266.43 g/mol. Its IUPAC name is 3-(4-piperidin-1-ylpiperidin-1-yl)pentanimidamide.

Molecular Properties

Compound Name3-(4-piperidin-1-ylpiperidin-1-yl)pentanimidamide
PubChem CID61242438
Molecular FormulaC15H30N4
Molecular Weight266.43 g/mol
Exact Mass266.25
IUPAC Name3-(4-piperidin-1-ylpiperidin-1-yl)pentanimidamide
SMILES[H]/N=C(\N)CC(CC)N1CCC(N2CCCCC2)CC1
InChIInChI=1S/C15H30N4/c1-2-13(12-15(16)17)19-10-6-14(7-11-19)18-8-4-3-5-9-18/h13-14H,2-12H2,1H3,(H3,16,17)
InChIKeyWFGCMXPQFDYDSP-UHFFFAOYSA-N
XLogP2.04
TPSA56.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

3-(3-piperidin-1-ylpyrrolidin-1-yl)pentanimidamide
CID 63170287
3-(3-hydroxypyrrolidin-1-yl)pentanimidamide
CID 62943568
3-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)pentanimidamide
CID 43620437
3-[3-(dimethylamino)pyrrolidin-1-yl]pentanimidamide
CID 63163878
3-(3,4-dihydroxypyrrolidin-1-yl)pentanimidamide
CID 106669793
3-(4-hydroxy-3-methylpiperidin-1-yl)pentanimidamide
CID 114678826
3-(4-propylpiperazin-1-yl)pentanimidamide
CID 43368022
3-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pentanimidamide
CID 66392705
3-(4-ethyl-4-methylpiperidin-1-yl)pentanimidamide
CID 63158707
3-[2-(2-hydroxyethyl)piperidin-1-yl]pentanimidamide
CID 43368010
3-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]pentanimidamide
CID 102726631
3-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)pentanimidamide
CID 43628265

Frequently Asked Questions

What is the IUPAC name of 3-(4-piperidin-1-ylpiperidin-1-yl)pentanimidamide?
The IUPAC name of 3-(4-piperidin-1-ylpiperidin-1-yl)pentanimidamide (CID 61242438) is 3-(4-piperidin-1-ylpiperidin-1-yl)pentanimidamide.
What is the SMILES notation for 3-(4-piperidin-1-ylpiperidin-1-yl)pentanimidamide?
The canonical SMILES for 3-(4-piperidin-1-ylpiperidin-1-yl)pentanimidamide is [H]/N=C(\N)CC(CC)N1CCC(N2CCCCC2)CC1.
What is the InChIKey of 3-(4-piperidin-1-ylpiperidin-1-yl)pentanimidamide?
The InChIKey is WFGCMXPQFDYDSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N4/c1-2-13(12-15(16)17)19-10-6-14(7-11-19)18-8-4-3-5-9-18/h13-14H,2-12H2,1H3,(H3,16,17).
What are the key properties of 3-(4-piperidin-1-ylpiperidin-1-yl)pentanimidamide?
3-(4-piperidin-1-ylpiperidin-1-yl)pentanimidamide has a molecular weight of 266.43 g/mol, XLogP of 2.04, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-piperidin-1-ylpiperidin-1-yl)pentanimidamide is sourced from PubChem (CID 61242438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).