N-ethyl-2,4-dimethyl-1-(4-methyl-2-pyridinyl)pentan-1-amine

C15H26N2 — CID 114284868

IUPACN-ethyl-2,4-dimethyl-1-(4-methyl-2-pyridinyl)pentan-1-amine
SMILESCCNC(c1cc(C)ccn1)C(C)CC(C)C
InChIInChI=1S/C15H26N2/c1-6-16-15(13(5)9-11(2)3)14-10-12(4)7-8-17-14/h7-8,10-11,13,15-16H,6,9H2,1-5H3
InChIKeyWTGBTIUBPPOGES-UHFFFAOYSA-N
MW234.39 g/mol
LogP3.72
Rot. Bonds6

About N-ethyl-2,4-dimethyl-1-(4-methyl-2-pyridinyl)pentan-1-amine

N-ethyl-2,4-dimethyl-1-(4-methyl-2-pyridinyl)pentan-1-amine (PubChem CID 114284868) has the molecular formula C15H26N2 and a molecular weight of 234.39 g/mol. Its IUPAC name is N-ethyl-2,4-dimethyl-1-(4-methyl-2-pyridinyl)pentan-1-amine.

Molecular Properties

Compound NameN-ethyl-2,4-dimethyl-1-(4-methyl-2-pyridinyl)pentan-1-amine
PubChem CID114284868
Molecular FormulaC15H26N2
Molecular Weight234.39 g/mol
Exact Mass234.21
IUPAC NameN-ethyl-2,4-dimethyl-1-(4-methyl-2-pyridinyl)pentan-1-amine
SMILESCCNC(c1cc(C)ccn1)C(C)CC(C)C
InChIInChI=1S/C15H26N2/c1-6-16-15(13(5)9-11(2)3)14-10-12(4)7-8-17-14/h7-8,10-11,13,15-16H,6,9H2,1-5H3
InChIKeyWTGBTIUBPPOGES-UHFFFAOYSA-N
XLogP3.72
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.39
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,4-dimethyl-1-(4-methyl-2-pyridinyl)pentan-1-amine?
The IUPAC name of N-ethyl-2,4-dimethyl-1-(4-methyl-2-pyridinyl)pentan-1-amine (CID 114284868) is N-ethyl-2,4-dimethyl-1-(4-methyl-2-pyridinyl)pentan-1-amine.
What is the SMILES notation for N-ethyl-2,4-dimethyl-1-(4-methyl-2-pyridinyl)pentan-1-amine?
The canonical SMILES for N-ethyl-2,4-dimethyl-1-(4-methyl-2-pyridinyl)pentan-1-amine is CCNC(c1cc(C)ccn1)C(C)CC(C)C.
What is the InChIKey of N-ethyl-2,4-dimethyl-1-(4-methyl-2-pyridinyl)pentan-1-amine?
The InChIKey is WTGBTIUBPPOGES-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2/c1-6-16-15(13(5)9-11(2)3)14-10-12(4)7-8-17-14/h7-8,10-11,13,15-16H,6,9H2,1-5H3.
What are the key properties of N-ethyl-2,4-dimethyl-1-(4-methyl-2-pyridinyl)pentan-1-amine?
N-ethyl-2,4-dimethyl-1-(4-methyl-2-pyridinyl)pentan-1-amine has a molecular weight of 234.39 g/mol, XLogP of 3.72, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,4-dimethyl-1-(4-methyl-2-pyridinyl)pentan-1-amine is sourced from PubChem (CID 114284868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).