1-(5-ethyl-2-pyridinyl)-N-methylbutan-2-amine

C12H20N2 — CID 79006788

IUPAC1-(5-ethyl-2-pyridinyl)-N-methylbutan-2-amine
SMILESCCc1ccc(CC(CC)NC)nc1
InChIInChI=1S/C12H20N2/c1-4-10-6-7-12(14-9-10)8-11(5-2)13-3/h6-7,9,11,13H,4-5,8H2,1-3H3
InChIKeyKXBBLPDCTDGDDV-UHFFFAOYSA-N
MW192.31 g/mol
LogP2.18
Rot. Bonds5

About 1-(5-ethyl-2-pyridinyl)-N-methylbutan-2-amine

1-(5-ethyl-2-pyridinyl)-N-methylbutan-2-amine (PubChem CID 79006788) has the molecular formula C12H20N2 and a molecular weight of 192.31 g/mol. Its IUPAC name is 1-(5-ethyl-2-pyridinyl)-N-methylbutan-2-amine.

Molecular Properties

Compound Name1-(5-ethyl-2-pyridinyl)-N-methylbutan-2-amine
PubChem CID79006788
Molecular FormulaC12H20N2
Molecular Weight192.31 g/mol
Exact Mass192.16
IUPAC Name1-(5-ethyl-2-pyridinyl)-N-methylbutan-2-amine
SMILESCCc1ccc(CC(CC)NC)nc1
InChIInChI=1S/C12H20N2/c1-4-10-6-7-12(14-9-10)8-11(5-2)13-3/h6-7,9,11,13H,4-5,8H2,1-3H3
InChIKeyKXBBLPDCTDGDDV-UHFFFAOYSA-N
XLogP2.18
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.31
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-butan-2-ylsulfanyl-3-(5-ethyl-2-pyridinyl)-N-methylpropan-2-amine
CID 79748150
1-(5-ethyl-2-pyridinyl)-N-methyldecan-2-amine
CID 105014407
N-methyl-1-(5-methyl-2-pyridinyl)butan-2-amine
CID 63201914
1-(3,5-difluorophenyl)-3-(5-ethyl-2-pyridinyl)-N-methylpropan-2-amine
CID 79732696
1-(5-ethyl-2-pyridinyl)-3-methoxy-N-methylpentan-2-amine
CID 116715456
1-(5-ethyl-2-pyridinyl)-N-methyl-4-pyridin-2-ylbutan-2-amine
CID 105168957
1-(5-ethyl-2-pyridinyl)-3-(3-methoxyphenyl)-N-methylpropan-2-amine
CID 79732394
1-(5-ethyl-2-pyridinyl)-N-methyl-3-(oxolan-3-yl)propan-2-amine
CID 103987022
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
3-ethyl-1-(5-ethyl-2-pyridinyl)-3-methoxy-N-methylpentan-2-amine
CID 116760887
[1-(4-bromophenyl)-3-(5-ethyl-2-pyridinyl)propan-2-yl]hydrazine
CID 105195480

Frequently Asked Questions

What is the IUPAC name of 1-(5-ethyl-2-pyridinyl)-N-methylbutan-2-amine?
The IUPAC name of 1-(5-ethyl-2-pyridinyl)-N-methylbutan-2-amine (CID 79006788) is 1-(5-ethyl-2-pyridinyl)-N-methylbutan-2-amine.
What is the SMILES notation for 1-(5-ethyl-2-pyridinyl)-N-methylbutan-2-amine?
The canonical SMILES for 1-(5-ethyl-2-pyridinyl)-N-methylbutan-2-amine is CCc1ccc(CC(CC)NC)nc1.
What is the InChIKey of 1-(5-ethyl-2-pyridinyl)-N-methylbutan-2-amine?
The InChIKey is KXBBLPDCTDGDDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2/c1-4-10-6-7-12(14-9-10)8-11(5-2)13-3/h6-7,9,11,13H,4-5,8H2,1-3H3.
What are the key properties of 1-(5-ethyl-2-pyridinyl)-N-methylbutan-2-amine?
1-(5-ethyl-2-pyridinyl)-N-methylbutan-2-amine has a molecular weight of 192.31 g/mol, XLogP of 2.18, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethyl-2-pyridinyl)-N-methylbutan-2-amine is sourced from PubChem (CID 79006788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).