N-ethyl-1-(3-ethyl-4-pyridinyl)-2-methylpentan-1-amine

C15H26N2 — CID 114013828

IUPACN-ethyl-1-(3-ethyl-4-pyridinyl)-2-methylpentan-1-amine
SMILESCCCC(C)C(NCC)c1ccncc1CC
InChIInChI=1S/C15H26N2/c1-5-8-12(4)15(17-7-3)14-9-10-16-11-13(14)6-2/h9-12,15,17H,5-8H2,1-4H3
InChIKeyZICJDCNHPVNTOK-UHFFFAOYSA-N
MW234.39 g/mol
LogP3.73
Rot. Bonds7

About N-ethyl-1-(3-ethyl-4-pyridinyl)-2-methylpentan-1-amine

N-ethyl-1-(3-ethyl-4-pyridinyl)-2-methylpentan-1-amine (PubChem CID 114013828) has the molecular formula C15H26N2 and a molecular weight of 234.39 g/mol. Its IUPAC name is N-ethyl-1-(3-ethyl-4-pyridinyl)-2-methylpentan-1-amine.

Molecular Properties

Compound NameN-ethyl-1-(3-ethyl-4-pyridinyl)-2-methylpentan-1-amine
PubChem CID114013828
Molecular FormulaC15H26N2
Molecular Weight234.39 g/mol
Exact Mass234.21
IUPAC NameN-ethyl-1-(3-ethyl-4-pyridinyl)-2-methylpentan-1-amine
SMILESCCCC(C)C(NCC)c1ccncc1CC
InChIInChI=1S/C15H26N2/c1-5-8-12(4)15(17-7-3)14-9-10-16-11-13(14)6-2/h9-12,15,17H,5-8H2,1-4H3
InChIKeyZICJDCNHPVNTOK-UHFFFAOYSA-N
XLogP3.73
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.39
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-2-methyl-1-pyridin-4-ylpentan-1-amine
CID 107893389
2-methyl-1-(3-methyl-4-pyridinyl)-N-propylpentan-1-amine
CID 107896816
N-ethyl-2-methyl-1-pyrazolo[1,5-a]pyrazin-3-ylpentan-1-amine
CID 114013583
N-ethyl-1-(3-ethyl-4-pyridinyl)-4-methoxybutan-1-amine
CID 114856842
1-(2-chlorofuran-3-yl)-N-ethyl-2-methylpentan-1-amine
CID 107893430
N,2-dimethyl-1-(4-methyl-3-pyridinyl)pentan-1-amine
CID 105006266
1-(3-fluoro-4-pyridinyl)-2-methyl-N-propylhexan-1-amine
CID 114246559
2-methyl-N-propyl-1-pyridin-3-ylpentan-1-amine
CID 115799813
3-(3-ethyl-4-pyridinyl)pentane-1,5-diol
CID 26793167
N-ethyl-1-(4-methyl-3-pyridinyl)pentan-1-amine
CID 79405563
N-ethyl-1-(2-fluoro-3-methylphenyl)-2-methylpentan-1-amine
CID 114013619
N-ethyl-2-methyl-1-(6-methyl-3-pyridinyl)pentan-1-amine
CID 115854971

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(3-ethyl-4-pyridinyl)-2-methylpentan-1-amine?
The IUPAC name of N-ethyl-1-(3-ethyl-4-pyridinyl)-2-methylpentan-1-amine (CID 114013828) is N-ethyl-1-(3-ethyl-4-pyridinyl)-2-methylpentan-1-amine.
What is the SMILES notation for N-ethyl-1-(3-ethyl-4-pyridinyl)-2-methylpentan-1-amine?
The canonical SMILES for N-ethyl-1-(3-ethyl-4-pyridinyl)-2-methylpentan-1-amine is CCCC(C)C(NCC)c1ccncc1CC.
What is the InChIKey of N-ethyl-1-(3-ethyl-4-pyridinyl)-2-methylpentan-1-amine?
The InChIKey is ZICJDCNHPVNTOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2/c1-5-8-12(4)15(17-7-3)14-9-10-16-11-13(14)6-2/h9-12,15,17H,5-8H2,1-4H3.
What are the key properties of N-ethyl-1-(3-ethyl-4-pyridinyl)-2-methylpentan-1-amine?
N-ethyl-1-(3-ethyl-4-pyridinyl)-2-methylpentan-1-amine has a molecular weight of 234.39 g/mol, XLogP of 3.73, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(3-ethyl-4-pyridinyl)-2-methylpentan-1-amine is sourced from PubChem (CID 114013828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).