N-ethyl-6-(5-ethyl-2-pyridinyl)-2-methylhexan-3-amine

C16H28N2 — CID 79738784

IUPACN-ethyl-6-(5-ethyl-2-pyridinyl)-2-methylhexan-3-amine
SMILESCCNC(CCCc1ccc(CC)cn1)C(C)C
InChIInChI=1S/C16H28N2/c1-5-14-10-11-15(18-12-14)8-7-9-16(13(3)4)17-6-2/h10-13,16-17H,5-9H2,1-4H3
InChIKeyUNWVFXGAQRFCQM-UHFFFAOYSA-N
MW248.41 g/mol
LogP3.60
Rot. Bonds8

About N-ethyl-6-(5-ethyl-2-pyridinyl)-2-methylhexan-3-amine

N-ethyl-6-(5-ethyl-2-pyridinyl)-2-methylhexan-3-amine (PubChem CID 79738784) has the molecular formula C16H28N2 and a molecular weight of 248.41 g/mol. Its IUPAC name is N-ethyl-6-(5-ethyl-2-pyridinyl)-2-methylhexan-3-amine.

Molecular Properties

Compound NameN-ethyl-6-(5-ethyl-2-pyridinyl)-2-methylhexan-3-amine
PubChem CID79738784
Molecular FormulaC16H28N2
Molecular Weight248.41 g/mol
Exact Mass248.23
IUPAC NameN-ethyl-6-(5-ethyl-2-pyridinyl)-2-methylhexan-3-amine
SMILESCCNC(CCCc1ccc(CC)cn1)C(C)C
InChIInChI=1S/C16H28N2/c1-5-14-10-11-15(18-12-14)8-7-9-16(13(3)4)17-6-2/h10-13,16-17H,5-9H2,1-4H3
InChIKeyUNWVFXGAQRFCQM-UHFFFAOYSA-N
XLogP3.60
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.41
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-ethyl-6-(5-ethyl-2-pyridinyl)-2-methylhexan-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-(5-bromo-2-pyridinyl)-N-ethyl-2-methylhexan-3-amine
CID 104812013
N-ethyl-6-(5-ethyl-2-pyridinyl)-2,2-dimethylhexan-3-amine
CID 79738785
5-(5-ethyl-2-pyridinyl)-N-methylpentan-2-amine
CID 79737887
6-(5-ethyl-2-pyridinyl)-2-methylhexan-3-amine
CID 79737589
2-(4-chloro-4-cyclopropylbutyl)-5-ethylpyridine
CID 79738882
4-(5-ethyl-2-pyridinyl)butan-1-ol
CID 79737697
N-ethyl-1-(5-ethyl-2-pyridinyl)-4-methylpentan-2-amine
CID 79748669
N-ethyl-1-(5-ethyl-2-pyridinyl)-4-phenylbutan-2-amine
CID 79732693
N-ethyl-2-methyl-6-(1-pentan-3-ylpyrazol-3-yl)hexan-3-amine
CID 64777005
N-ethyl-4-methyl-1-pyridin-2-ylpentan-3-amine
CID 105078244
N-ethyl-1-(5-ethyl-2-pyridinyl)-5-methoxyhexan-2-amine
CID 105168893
N-ethyl-1-(5-ethyl-2-pyridinyl)-5-methoxypentan-2-amine
CID 79748225

Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-(5-ethyl-2-pyridinyl)-2-methylhexan-3-amine?
The IUPAC name of N-ethyl-6-(5-ethyl-2-pyridinyl)-2-methylhexan-3-amine (CID 79738784) is N-ethyl-6-(5-ethyl-2-pyridinyl)-2-methylhexan-3-amine.
What is the SMILES notation for N-ethyl-6-(5-ethyl-2-pyridinyl)-2-methylhexan-3-amine?
The canonical SMILES for N-ethyl-6-(5-ethyl-2-pyridinyl)-2-methylhexan-3-amine is CCNC(CCCc1ccc(CC)cn1)C(C)C.
What is the InChIKey of N-ethyl-6-(5-ethyl-2-pyridinyl)-2-methylhexan-3-amine?
The InChIKey is UNWVFXGAQRFCQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2/c1-5-14-10-11-15(18-12-14)8-7-9-16(13(3)4)17-6-2/h10-13,16-17H,5-9H2,1-4H3.
What are the key properties of N-ethyl-6-(5-ethyl-2-pyridinyl)-2-methylhexan-3-amine?
N-ethyl-6-(5-ethyl-2-pyridinyl)-2-methylhexan-3-amine has a molecular weight of 248.41 g/mol, XLogP of 3.60, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-(5-ethyl-2-pyridinyl)-2-methylhexan-3-amine is sourced from PubChem (CID 79738784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).