N,N-bis(2-ethoxyethyl)-1-pyridin-2-ylethane-1,2-diamine

C15H27N3O2 — CID 82965174

IUPACN,N-bis(2-ethoxyethyl)-1-pyridin-2-ylethane-1,2-diamine
SMILESCCOCCN(CCOCC)C(CN)c1ccccn1
InChIInChI=1S/C15H27N3O2/c1-3-19-11-9-18(10-12-20-4-2)15(13-16)14-7-5-6-8-17-14/h5-8,15H,3-4,9-13,16H2,1-2H3
InChIKeyQFDYPWFSIPMWMO-UHFFFAOYSA-N
MW281.40 g/mol
LogP1.46
Rot. Bonds11

About N,N-bis(2-ethoxyethyl)-1-pyridin-2-ylethane-1,2-diamine

N,N-bis(2-ethoxyethyl)-1-pyridin-2-ylethane-1,2-diamine (PubChem CID 82965174) has the molecular formula C15H27N3O2 and a molecular weight of 281.40 g/mol. Its IUPAC name is N,N-bis(2-ethoxyethyl)-1-pyridin-2-ylethane-1,2-diamine.

Molecular Properties

Compound NameN,N-bis(2-ethoxyethyl)-1-pyridin-2-ylethane-1,2-diamine
PubChem CID82965174
Molecular FormulaC15H27N3O2
Molecular Weight281.40 g/mol
Exact Mass281.21
IUPAC NameN,N-bis(2-ethoxyethyl)-1-pyridin-2-ylethane-1,2-diamine
SMILESCCOCCN(CCOCC)C(CN)c1ccccn1
InChIInChI=1S/C15H27N3O2/c1-3-19-11-9-18(10-12-20-4-2)15(13-16)14-7-5-6-8-17-14/h5-8,15H,3-4,9-13,16H2,1-2H3
InChIKeyQFDYPWFSIPMWMO-UHFFFAOYSA-N
XLogP1.46
TPSA60.61 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-[(2-amino-1-pyridin-2-ylethyl)-(2-methoxyethyl)amino]propanenitrile
CID 63284752
1-(4-chlorophenyl)-N,N-bis(2-ethoxyethyl)ethane-1,2-diamine
CID 82959955
2-[(2-amino-1-pyridin-2-ylethyl)-methylamino]propan-1-ol
CID 104551342
N-butan-2-yl-N-butyl-1-pyridin-2-ylethane-1,2-diamine
CID 55004964
3-ethoxy-N-methyl-1-pyridin-2-ylpropan-1-amine
CID 114997349
N,N-bis(2-ethoxyethyl)-1-(3-methylimidazol-4-yl)ethane-1,2-diamine
CID 82965069
2-[(2R)-1-ethoxypropan-2-yl]pyridine
CID 122697916
N-(2-ethoxyethyl)-N-methyl-1-quinolin-6-ylethane-1,2-diamine
CID 81058699
N-methyl-N-(4-methylphenyl)-1-pyridin-2-ylethane-1,2-diamine
CID 114991327
2-pyridin-2-ylpropan-1-amine
CID 21481533
N-[(4-methoxyphenyl)methyl]-N-methyl-1-pyridin-2-ylethane-1,2-diamine
CID 61419935
1-(3-chlorophenyl)-N-(2-ethoxyethyl)-N-ethylethane-1,2-diamine
CID 63695739

Frequently Asked Questions

What is the IUPAC name of N,N-bis(2-ethoxyethyl)-1-pyridin-2-ylethane-1,2-diamine?
The IUPAC name of N,N-bis(2-ethoxyethyl)-1-pyridin-2-ylethane-1,2-diamine (CID 82965174) is N,N-bis(2-ethoxyethyl)-1-pyridin-2-ylethane-1,2-diamine.
What is the SMILES notation for N,N-bis(2-ethoxyethyl)-1-pyridin-2-ylethane-1,2-diamine?
The canonical SMILES for N,N-bis(2-ethoxyethyl)-1-pyridin-2-ylethane-1,2-diamine is CCOCCN(CCOCC)C(CN)c1ccccn1.
What is the InChIKey of N,N-bis(2-ethoxyethyl)-1-pyridin-2-ylethane-1,2-diamine?
The InChIKey is QFDYPWFSIPMWMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O2/c1-3-19-11-9-18(10-12-20-4-2)15(13-16)14-7-5-6-8-17-14/h5-8,15H,3-4,9-13,16H2,1-2H3.
What are the key properties of N,N-bis(2-ethoxyethyl)-1-pyridin-2-ylethane-1,2-diamine?
N,N-bis(2-ethoxyethyl)-1-pyridin-2-ylethane-1,2-diamine has a molecular weight of 281.40 g/mol, XLogP of 1.46, 11 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(2-ethoxyethyl)-1-pyridin-2-ylethane-1,2-diamine is sourced from PubChem (CID 82965174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).