cyanamide;cyclopentane;1-hexan-2-ylpiperazine

C16H34N4 — CID 143761748

IUPACcyanamide;cyclopentane;1-hexan-2-ylpiperazine
SMILESC1CCCC1.CCCCC(C)N1CCNCC1.N#CN
InChIInChI=1S/C10H22N2.C5H10.CH2N2/c1-3-4-5-10(2)12-8-6-11-7-9-12;1-2-4-5-3-1;2-1-3/h10-11H,3-9H2,1-2H3;1-5H2;2H2
InChIKeyLDDJLRPYXWLZAQ-UHFFFAOYSA-N
MW282.48 g/mol
LogP2.85
Rot. Bonds4

About cyanamide;cyclopentane;1-hexan-2-ylpiperazine

cyanamide;cyclopentane;1-hexan-2-ylpiperazine (PubChem CID 143761748) has the molecular formula C16H34N4 and a molecular weight of 282.48 g/mol. Its IUPAC name is cyanamide;cyclopentane;1-hexan-2-ylpiperazine.

Molecular Properties

Compound Namecyanamide;cyclopentane;1-hexan-2-ylpiperazine
PubChem CID143761748
Molecular FormulaC16H34N4
Molecular Weight282.48 g/mol
Exact Mass282.28
IUPAC Namecyanamide;cyclopentane;1-hexan-2-ylpiperazine
SMILESC1CCCC1.CCCCC(C)N1CCNCC1.N#CN
InChIInChI=1S/C10H22N2.C5H10.CH2N2/c1-3-4-5-10(2)12-8-6-11-7-9-12;1-2-4-5-3-1;2-1-3/h10-11H,3-9H2,1-2H3;1-5H2;2H2
InChIKeyLDDJLRPYXWLZAQ-UHFFFAOYSA-N
XLogP2.85
TPSA65.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.48
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'cyanate_/aminonitrile_/thiocyanate', 'substructure': 'N/A'}, {'alert_name': 'enamine', 'substructure': 'N/A'}

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Related Compounds

1-heptan-2-ylpiperazine
CID 61464712
1-hexan-2-yl-1,5-diazocane
CID 62200653
1-octan-2-yl-1,4-diazepane
CID 61057071
2-(1,4-diazepan-1-yl)hexanenitrile
CID 61353151
(4S)-4-piperazin-1-ylpentan-1-ol
CID 94830721
1-(5-piperazin-1-ylhexan-2-yl)-4-propan-2-ylpiperazine
CID 155105121
1-dodecan-2-ylpyrrolidine
CID 70871228
1-hexan-2-yl-4-propan-2-ylpiperidine
CID 67564256
4-[(2S)-hexan-2-yl]morpholine
CID 124506548
1-hexan-2-yl-3,7-dimethyl-1,5-diazocane
CID 62200461
1-(4-methylsulfanylbutan-2-yl)piperazine
CID 112703762
2-(1,4-diazepan-1-yl)hexan-1-ol
CID 61352767

Frequently Asked Questions

What is the IUPAC name of cyanamide;cyclopentane;1-hexan-2-ylpiperazine?
The IUPAC name of cyanamide;cyclopentane;1-hexan-2-ylpiperazine (CID 143761748) is cyanamide;cyclopentane;1-hexan-2-ylpiperazine.
What is the SMILES notation for cyanamide;cyclopentane;1-hexan-2-ylpiperazine?
The canonical SMILES for cyanamide;cyclopentane;1-hexan-2-ylpiperazine is C1CCCC1.CCCCC(C)N1CCNCC1.N#CN.
What is the InChIKey of cyanamide;cyclopentane;1-hexan-2-ylpiperazine?
The InChIKey is LDDJLRPYXWLZAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2.C5H10.CH2N2/c1-3-4-5-10(2)12-8-6-11-7-9-12;1-2-4-5-3-1;2-1-3/h10-11H,3-9H2,1-2H3;1-5H2;2H2.
What are the key properties of cyanamide;cyclopentane;1-hexan-2-ylpiperazine?
cyanamide;cyclopentane;1-hexan-2-ylpiperazine has a molecular weight of 282.48 g/mol, XLogP of 2.85, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cyanamide;cyclopentane;1-hexan-2-ylpiperazine is sourced from PubChem (CID 143761748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).