4-butyl-N-ethyl-N-methylpyridin-2-amine

C12H20N2 — CID 142596545

IUPAC4-butyl-N-ethyl-N-methylpyridin-2-amine
SMILESCCCCc1ccnc(N(C)CC)c1
InChIInChI=1S/C12H20N2/c1-4-6-7-11-8-9-13-12(10-11)14(3)5-2/h8-10H,4-7H2,1-3H3
InChIKeyFTXRTONPPLICEQ-UHFFFAOYSA-N
MW192.31 g/mol
LogP2.88
Rot. Bonds5

About 4-butyl-N-ethyl-N-methylpyridin-2-amine

4-butyl-N-ethyl-N-methylpyridin-2-amine (PubChem CID 142596545) has the molecular formula C12H20N2 and a molecular weight of 192.31 g/mol. Its IUPAC name is 4-butyl-N-ethyl-N-methylpyridin-2-amine.

Molecular Properties

Compound Name4-butyl-N-ethyl-N-methylpyridin-2-amine
PubChem CID142596545
Molecular FormulaC12H20N2
Molecular Weight192.31 g/mol
Exact Mass192.16
IUPAC Name4-butyl-N-ethyl-N-methylpyridin-2-amine
SMILESCCCCc1ccnc(N(C)CC)c1
InChIInChI=1S/C12H20N2/c1-4-6-7-11-8-9-13-12(10-11)14(3)5-2/h8-10H,4-7H2,1-3H3
InChIKeyFTXRTONPPLICEQ-UHFFFAOYSA-N
XLogP2.88
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.31
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-butyl-N-ethyl-N-methylpyridin-2-amine?
The IUPAC name of 4-butyl-N-ethyl-N-methylpyridin-2-amine (CID 142596545) is 4-butyl-N-ethyl-N-methylpyridin-2-amine.
What is the SMILES notation for 4-butyl-N-ethyl-N-methylpyridin-2-amine?
The canonical SMILES for 4-butyl-N-ethyl-N-methylpyridin-2-amine is CCCCc1ccnc(N(C)CC)c1.
What is the InChIKey of 4-butyl-N-ethyl-N-methylpyridin-2-amine?
The InChIKey is FTXRTONPPLICEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2/c1-4-6-7-11-8-9-13-12(10-11)14(3)5-2/h8-10H,4-7H2,1-3H3.
What are the key properties of 4-butyl-N-ethyl-N-methylpyridin-2-amine?
4-butyl-N-ethyl-N-methylpyridin-2-amine has a molecular weight of 192.31 g/mol, XLogP of 2.88, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-butyl-N-ethyl-N-methylpyridin-2-amine is sourced from PubChem (CID 142596545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).