N,2-diethyl-N-(2-pyridin-4-ylethyl)butan-1-amine

C15H26N2 — CID 78896115

IUPACN,2-diethyl-N-(2-pyridin-4-ylethyl)butan-1-amine
SMILESCCC(CC)CN(CC)CCc1ccncc1
InChIInChI=1S/C15H26N2/c1-4-14(5-2)13-17(6-3)12-9-15-7-10-16-11-8-15/h7-8,10-11,14H,4-6,9,12-13H2,1-3H3
InChIKeyAUSWQMYQYDLYQX-UHFFFAOYSA-N
MW234.39 g/mol
LogP3.38
Rot. Bonds8

About N,2-diethyl-N-(2-pyridin-4-ylethyl)butan-1-amine

N,2-diethyl-N-(2-pyridin-4-ylethyl)butan-1-amine (PubChem CID 78896115) has the molecular formula C15H26N2 and a molecular weight of 234.39 g/mol. Its IUPAC name is N,2-diethyl-N-(2-pyridin-4-ylethyl)butan-1-amine.

Molecular Properties

Compound NameN,2-diethyl-N-(2-pyridin-4-ylethyl)butan-1-amine
PubChem CID78896115
Molecular FormulaC15H26N2
Molecular Weight234.39 g/mol
Exact Mass234.21
IUPAC NameN,2-diethyl-N-(2-pyridin-4-ylethyl)butan-1-amine
SMILESCCC(CC)CN(CC)CCc1ccncc1
InChIInChI=1S/C15H26N2/c1-4-14(5-2)13-17(6-3)12-9-15-7-10-16-11-8-15/h7-8,10-11,14H,4-6,9,12-13H2,1-3H3
InChIKeyAUSWQMYQYDLYQX-UHFFFAOYSA-N
XLogP3.38
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.39
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[4-(aminomethyl)phenyl]methyl]-2-ethyl-N-(pyridin-4-ylmethyl)butan-1-amine
CID 23992654
2-[ethyl(2-pyridin-4-ylethyl)amino]-1-pyridin-2-ylethanol
CID 82216622
N'-ethyl-2-propyl-N'-(pyridin-4-ylmethyl)propane-1,3-diamine
CID 65233301
N'-ethyl-2-methoxy-N'-(pyridin-4-ylmethyl)propane-1,3-diamine
CID 106114657
2-N-ethyl-2-methyl-2-N-(2-pyridin-4-ylethyl)propane-1,2-diamine
CID 62009355
(2S)-1-N-methyl-1-N-(2-pyridin-4-ylethyl)butane-1,2-diamine
CID 7138367
N-(diethoxyphosphorylmethyl)-N-ethyl-2-pyridin-4-ylethanamine
CID 4609833
2-ethoxy-N'-ethyl-N'-(pyridin-4-ylmethyl)propane-1,3-diamine
CID 55146279
(2R,3R)-1-N,3-dimethyl-1-N-(2-pyridin-4-ylethyl)pentane-1,2-diamine
CID 94174191
3-[ethyl(2-pyridin-4-ylethyl)amino]-1-thiophen-2-ylpropan-1-ol
CID 82074199
1-N-ethyl-4-methyl-1-N-(pyridin-4-ylmethyl)pentane-1,2-diamine
CID 54948017
1-N,2-N-diethyl-1-N-(pyridin-4-ylmethyl)butane-1,2-diamine
CID 62038864

Frequently Asked Questions

What is the IUPAC name of N,2-diethyl-N-(2-pyridin-4-ylethyl)butan-1-amine?
The IUPAC name of N,2-diethyl-N-(2-pyridin-4-ylethyl)butan-1-amine (CID 78896115) is N,2-diethyl-N-(2-pyridin-4-ylethyl)butan-1-amine.
What is the SMILES notation for N,2-diethyl-N-(2-pyridin-4-ylethyl)butan-1-amine?
The canonical SMILES for N,2-diethyl-N-(2-pyridin-4-ylethyl)butan-1-amine is CCC(CC)CN(CC)CCc1ccncc1.
What is the InChIKey of N,2-diethyl-N-(2-pyridin-4-ylethyl)butan-1-amine?
The InChIKey is AUSWQMYQYDLYQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2/c1-4-14(5-2)13-17(6-3)12-9-15-7-10-16-11-8-15/h7-8,10-11,14H,4-6,9,12-13H2,1-3H3.
What are the key properties of N,2-diethyl-N-(2-pyridin-4-ylethyl)butan-1-amine?
N,2-diethyl-N-(2-pyridin-4-ylethyl)butan-1-amine has a molecular weight of 234.39 g/mol, XLogP of 3.38, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-diethyl-N-(2-pyridin-4-ylethyl)butan-1-amine is sourced from PubChem (CID 78896115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).