1-piperazin-2-ylidenebutan-1-amine

C8H17N3 — CID 140984375

IUPAC1-piperazin-2-ylidenebutan-1-amine
SMILESCCCC(N)=C1CNCCN1
InChIInChI=1S/C8H17N3/c1-2-3-7(9)8-6-10-4-5-11-8/h10-11H,2-6,9H2,1H3
InChIKeyLZKGHZPUUWNAQU-UHFFFAOYSA-N
MW155.24 g/mol
LogP0.15
Rot. Bonds2

About 1-piperazin-2-ylidenebutan-1-amine

1-piperazin-2-ylidenebutan-1-amine (PubChem CID 140984375) has the molecular formula C8H17N3 and a molecular weight of 155.24 g/mol. Its IUPAC name is 1-piperazin-2-ylidenebutan-1-amine.

Molecular Properties

Compound Name1-piperazin-2-ylidenebutan-1-amine
PubChem CID140984375
Molecular FormulaC8H17N3
Molecular Weight155.24 g/mol
Exact Mass155.14
IUPAC Name1-piperazin-2-ylidenebutan-1-amine
SMILESCCCC(N)=C1CNCCN1
InChIInChI=1S/C8H17N3/c1-2-3-7(9)8-6-10-4-5-11-8/h10-11H,2-6,9H2,1H3
InChIKeyLZKGHZPUUWNAQU-UHFFFAOYSA-N
XLogP0.15
TPSA50.08 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 50.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

azane;(E)-4-piperazin-1-ylhex-3-en-3-amine
CID 67594519
(E)-4-piperazin-1-ylhex-3-en-3-amine
CID 67594520
4-Piperazin-1-ylhex-3-en-3-amine
CID 69293290
2-Cyclobutylidene-1-methylpiperazine
CID 88977894
N,4-dimethyl-1,2,3,6-tetrahydropyridin-5-amine;ethane
CID 123241224
N-methyl-1-(5-methyl-1,2,3,4-tetrahydropyridin-6-yl)methanamine
CID 134292152
(Z)-4-methyl-2-piperazin-1-ylhex-3-en-3-amine
CID 139395126
(Z)-1-N,2-N-dimethylhex-2-ene-1,2,3-triamine
CID 139458625
1-Methyl-2-propylidenepiperazine
CID 139506778
(2E)-2-butylidene-6-methylpiperazine
CID 141787513
2-Cyclobutylidene-6-methylpiperazine
CID 141787638
(Z)-N,N-diethyl-3-methyl-4-(2-methylpiperazin-1-yl)pent-3-en-1-amine
CID 143271970

Frequently Asked Questions

What is the IUPAC name of 1-piperazin-2-ylidenebutan-1-amine?
The IUPAC name of 1-piperazin-2-ylidenebutan-1-amine (CID 140984375) is 1-piperazin-2-ylidenebutan-1-amine.
What is the SMILES notation for 1-piperazin-2-ylidenebutan-1-amine?
The canonical SMILES for 1-piperazin-2-ylidenebutan-1-amine is CCCC(N)=C1CNCCN1.
What is the InChIKey of 1-piperazin-2-ylidenebutan-1-amine?
The InChIKey is LZKGHZPUUWNAQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3/c1-2-3-7(9)8-6-10-4-5-11-8/h10-11H,2-6,9H2,1H3.
What are the key properties of 1-piperazin-2-ylidenebutan-1-amine?
1-piperazin-2-ylidenebutan-1-amine has a molecular weight of 155.24 g/mol, XLogP of 0.15, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperazin-2-ylidenebutan-1-amine is sourced from PubChem (CID 140984375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).