N-ethyl-1-(5-ethyl-2-pyridinyl)-4-phenylbutan-2-amine

C19H26N2 — CID 79732693

IUPACN-ethyl-1-(5-ethyl-2-pyridinyl)-4-phenylbutan-2-amine
SMILESCCNC(CCc1ccccc1)Cc1ccc(CC)cn1
InChIInChI=1S/C19H26N2/c1-3-16-10-12-19(21-15-16)14-18(20-4-2)13-11-17-8-6-5-7-9-17/h5-10,12,15,18,20H,3-4,11,13-14H2,1-2H3
InChIKeyYVUSRBIHHJBFPA-UHFFFAOYSA-N
MW282.43 g/mol
LogP3.80
Rot. Bonds8

About N-ethyl-1-(5-ethyl-2-pyridinyl)-4-phenylbutan-2-amine

N-ethyl-1-(5-ethyl-2-pyridinyl)-4-phenylbutan-2-amine (PubChem CID 79732693) has the molecular formula C19H26N2 and a molecular weight of 282.43 g/mol. Its IUPAC name is N-ethyl-1-(5-ethyl-2-pyridinyl)-4-phenylbutan-2-amine.

Molecular Properties

Compound NameN-ethyl-1-(5-ethyl-2-pyridinyl)-4-phenylbutan-2-amine
PubChem CID79732693
Molecular FormulaC19H26N2
Molecular Weight282.43 g/mol
Exact Mass282.21
IUPAC NameN-ethyl-1-(5-ethyl-2-pyridinyl)-4-phenylbutan-2-amine
SMILESCCNC(CCc1ccccc1)Cc1ccc(CC)cn1
InChIInChI=1S/C19H26N2/c1-3-16-10-12-19(21-15-16)14-18(20-4-2)13-11-17-8-6-5-7-9-17/h5-10,12,15,18,20H,3-4,11,13-14H2,1-2H3
InChIKeyYVUSRBIHHJBFPA-UHFFFAOYSA-N
XLogP3.80
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-1-(5-ethyl-2-pyridinyl)-4-propoxybutan-2-amine
CID 105168889
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
N-ethyl-1-(5-ethyl-2-pyridinyl)-4-methylpentan-2-amine
CID 79748669
2-N-ethyl-3-(5-ethyl-2-pyridinyl)-1-N,1-N-dimethylpropane-1,2-diamine
CID 79748096
1-(5-ethyl-2-pyridinyl)-N-propylhexan-2-amine
CID 79747783
1-(5-ethyl-2-pyridinyl)-N-methyl-4-pyridin-2-ylbutan-2-amine
CID 105168957
[1-(5-ethyl-2-pyridinyl)-4-(3-methylphenyl)butan-2-yl]hydrazine
CID 105324467
N-ethyl-1-(2-methylphenyl)-4-phenylbutan-2-amine
CID 61065597
1-(5-ethyl-2-pyridinyl)-3-phenylpropan-2-amine
CID 79748258
1-(5-ethyl-2-pyridinyl)-3-phenylpropan-2-ol
CID 79740538
1-(5-ethyl-2-pyridinyl)-N-methylbutan-2-amine
CID 79006788

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(5-ethyl-2-pyridinyl)-4-phenylbutan-2-amine?
The IUPAC name of N-ethyl-1-(5-ethyl-2-pyridinyl)-4-phenylbutan-2-amine (CID 79732693) is N-ethyl-1-(5-ethyl-2-pyridinyl)-4-phenylbutan-2-amine.
What is the SMILES notation for N-ethyl-1-(5-ethyl-2-pyridinyl)-4-phenylbutan-2-amine?
The canonical SMILES for N-ethyl-1-(5-ethyl-2-pyridinyl)-4-phenylbutan-2-amine is CCNC(CCc1ccccc1)Cc1ccc(CC)cn1.
What is the InChIKey of N-ethyl-1-(5-ethyl-2-pyridinyl)-4-phenylbutan-2-amine?
The InChIKey is YVUSRBIHHJBFPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2/c1-3-16-10-12-19(21-15-16)14-18(20-4-2)13-11-17-8-6-5-7-9-17/h5-10,12,15,18,20H,3-4,11,13-14H2,1-2H3.
What are the key properties of N-ethyl-1-(5-ethyl-2-pyridinyl)-4-phenylbutan-2-amine?
N-ethyl-1-(5-ethyl-2-pyridinyl)-4-phenylbutan-2-amine has a molecular weight of 282.43 g/mol, XLogP of 3.80, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(5-ethyl-2-pyridinyl)-4-phenylbutan-2-amine is sourced from PubChem (CID 79732693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).