2-N,2-N,3-N,3-N-tetraethyl-6-piperazin-1-ylpyridine-2,3-diamine

C17H31N5 — CID 14654942

IUPAC2-N,2-N,3-N,3-N-tetraethyl-6-piperazin-1-ylpyridine-2,3-diamine
SMILESCCN(CC)c1ccc(N2CCNCC2)nc1N(CC)CC
InChIInChI=1S/C17H31N5/c1-5-20(6-2)15-9-10-16(22-13-11-18-12-14-22)19-17(15)21(7-3)8-4/h9-10,18H,5-8,11-14H2,1-4H3
InChIKeyFSMJFAVJPMGFSD-UHFFFAOYSA-N
MW305.47 g/mol
LogP2.18
Rot. Bonds7

About 2-N,2-N,3-N,3-N-tetraethyl-6-piperazin-1-ylpyridine-2,3-diamine

2-N,2-N,3-N,3-N-tetraethyl-6-piperazin-1-ylpyridine-2,3-diamine (PubChem CID 14654942) has the molecular formula C17H31N5 and a molecular weight of 305.47 g/mol. Its IUPAC name is 2-N,2-N,3-N,3-N-tetraethyl-6-piperazin-1-ylpyridine-2,3-diamine.

Molecular Properties

Compound Name2-N,2-N,3-N,3-N-tetraethyl-6-piperazin-1-ylpyridine-2,3-diamine
PubChem CID14654942
Molecular FormulaC17H31N5
Molecular Weight305.47 g/mol
Exact Mass305.26
IUPAC Name2-N,2-N,3-N,3-N-tetraethyl-6-piperazin-1-ylpyridine-2,3-diamine
SMILESCCN(CC)c1ccc(N2CCNCC2)nc1N(CC)CC
InChIInChI=1S/C17H31N5/c1-5-20(6-2)15-9-10-16(22-13-11-18-12-14-22)19-17(15)21(7-3)8-4/h9-10,18H,5-8,11-14H2,1-4H3
InChIKeyFSMJFAVJPMGFSD-UHFFFAOYSA-N
XLogP2.18
TPSA34.64 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.47
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N,N-diethyl-3-nitro-6-piperazin-1-ylpyridin-2-amine
CID 14654938
2-N,2-N-diethyl-5-N,5-N-dimethyl-6-piperazin-1-ylpyridine-2,5-diamine
CID 22418764
N,N-diethyl-4-(4-methylpiperazin-1-yl)-6-piperazin-1-ylpyrimidin-2-amine
CID 22418791
N,N-diethyl-4-methyl-6-piperazin-1-ylpyrimidin-2-amine
CID 83726827
2-N,5-N-diethyl-6-piperazin-1-yl-2-N,5-N-bis(prop-2-enyl)pyridine-2,5-diamine
CID 23198076
6-ethoxy-2-piperazin-1-ylquinoline
CID 82166097
2-ethyl-4-piperazin-1-ylpyrimidine;dihydrochloride
CID 18698026
1-(2-methyl-6-piperazin-1-yl-3-pyridinyl)propan-1-ol
CID 102546266
1-[6-ethylsulfanyl-5-(trifluoromethyl)-2-pyridinyl]piperazine
CID 11725490
2-piperazin-1-yl-6-propan-2-ylquinoline
CID 82166087
6-chloro-N,N-diethyl-4-piperazin-1-ylpyridin-2-amine
CID 19379437
2-methoxy-6-piperazin-1-ylpyridin-3-amine
CID 62137469

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N,3-N,3-N-tetraethyl-6-piperazin-1-ylpyridine-2,3-diamine?
The IUPAC name of 2-N,2-N,3-N,3-N-tetraethyl-6-piperazin-1-ylpyridine-2,3-diamine (CID 14654942) is 2-N,2-N,3-N,3-N-tetraethyl-6-piperazin-1-ylpyridine-2,3-diamine.
What is the SMILES notation for 2-N,2-N,3-N,3-N-tetraethyl-6-piperazin-1-ylpyridine-2,3-diamine?
The canonical SMILES for 2-N,2-N,3-N,3-N-tetraethyl-6-piperazin-1-ylpyridine-2,3-diamine is CCN(CC)c1ccc(N2CCNCC2)nc1N(CC)CC.
What is the InChIKey of 2-N,2-N,3-N,3-N-tetraethyl-6-piperazin-1-ylpyridine-2,3-diamine?
The InChIKey is FSMJFAVJPMGFSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H31N5/c1-5-20(6-2)15-9-10-16(22-13-11-18-12-14-22)19-17(15)21(7-3)8-4/h9-10,18H,5-8,11-14H2,1-4H3.
What are the key properties of 2-N,2-N,3-N,3-N-tetraethyl-6-piperazin-1-ylpyridine-2,3-diamine?
2-N,2-N,3-N,3-N-tetraethyl-6-piperazin-1-ylpyridine-2,3-diamine has a molecular weight of 305.47 g/mol, XLogP of 2.18, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N,3-N,3-N-tetraethyl-6-piperazin-1-ylpyridine-2,3-diamine is sourced from PubChem (CID 14654942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).