N,N-diethyl-2-piperazin-1-yl-2-pyridin-4-ylethanamine

C15H26N4 — CID 83980045

IUPACN,N-diethyl-2-piperazin-1-yl-2-pyridin-4-ylethanamine
SMILESCCN(CC)CC(c1ccncc1)N1CCNCC1
InChIInChI=1S/C15H26N4/c1-3-18(4-2)13-15(14-5-7-16-8-6-14)19-11-9-17-10-12-19/h5-8,15,17H,3-4,9-13H2,1-2H3
InChIKeyHEIUMBJFUDGZTM-UHFFFAOYSA-N
MW262.40 g/mol
LogP1.37
Rot. Bonds6

About N,N-diethyl-2-piperazin-1-yl-2-pyridin-4-ylethanamine

N,N-diethyl-2-piperazin-1-yl-2-pyridin-4-ylethanamine (PubChem CID 83980045) has the molecular formula C15H26N4 and a molecular weight of 262.40 g/mol. Its IUPAC name is N,N-diethyl-2-piperazin-1-yl-2-pyridin-4-ylethanamine.

Molecular Properties

Compound NameN,N-diethyl-2-piperazin-1-yl-2-pyridin-4-ylethanamine
PubChem CID83980045
Molecular FormulaC15H26N4
Molecular Weight262.40 g/mol
Exact Mass262.22
IUPAC NameN,N-diethyl-2-piperazin-1-yl-2-pyridin-4-ylethanamine
SMILESCCN(CC)CC(c1ccncc1)N1CCNCC1
InChIInChI=1S/C15H26N4/c1-3-18(4-2)13-15(14-5-7-16-8-6-14)19-11-9-17-10-12-19/h5-8,15,17H,3-4,9-13H2,1-2H3
InChIKeyHEIUMBJFUDGZTM-UHFFFAOYSA-N
XLogP1.37
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1-pyridin-4-ylpropyl)-1,4-diazepane
CID 3349010
N,N-diethyl-2-piperazin-1-yl-2-thiophen-2-ylethanamine
CID 83979379
2-(3-chlorophenyl)-N,N-diethyl-2-piperazin-1-ylethanamine
CID 83977802
2-chloro-4-[2-(diethylamino)-1-piperazin-1-ylethyl]phenol
CID 83979656
1-[(1S)-3,3,3-trifluoro-1-pyridin-4-ylpropyl]piperazine;dihydrochloride
CID 171302429
1-[(1S)-1-pyridin-4-ylethyl]piperazine;dihydrochloride
CID 171274136
N,N-dimethyl-2-(3-methylpiperazin-1-yl)-2-pyridin-4-ylethanamine
CID 83980043
1-[(1S)-1-pyridin-3-ylpropyl]piperazine
CID 92764058
1-[phenyl(pyridin-4-yl)methyl]piperazine
CID 5035634
1-[(1R)-1-phenylpropyl]piperazine;dihydrochloride
CID 171295514
1-[(1R)-1-(4-fluorophenyl)propyl]piperazine
CID 28798751
1-[(1R)-1-(4-methylphenyl)propyl]piperazine;dihydrochloride
CID 171294154

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-piperazin-1-yl-2-pyridin-4-ylethanamine?
The IUPAC name of N,N-diethyl-2-piperazin-1-yl-2-pyridin-4-ylethanamine (CID 83980045) is N,N-diethyl-2-piperazin-1-yl-2-pyridin-4-ylethanamine.
What is the SMILES notation for N,N-diethyl-2-piperazin-1-yl-2-pyridin-4-ylethanamine?
The canonical SMILES for N,N-diethyl-2-piperazin-1-yl-2-pyridin-4-ylethanamine is CCN(CC)CC(c1ccncc1)N1CCNCC1.
What is the InChIKey of N,N-diethyl-2-piperazin-1-yl-2-pyridin-4-ylethanamine?
The InChIKey is HEIUMBJFUDGZTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4/c1-3-18(4-2)13-15(14-5-7-16-8-6-14)19-11-9-17-10-12-19/h5-8,15,17H,3-4,9-13H2,1-2H3.
What are the key properties of N,N-diethyl-2-piperazin-1-yl-2-pyridin-4-ylethanamine?
N,N-diethyl-2-piperazin-1-yl-2-pyridin-4-ylethanamine has a molecular weight of 262.40 g/mol, XLogP of 1.37, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-piperazin-1-yl-2-pyridin-4-ylethanamine is sourced from PubChem (CID 83980045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).