2-methyl-N-[1-(5-methyl-3-pyridinyl)ethyl]propan-2-amine

C12H20N2 — CID 130660349

IUPAC2-methyl-N-[1-(5-methyl-3-pyridinyl)ethyl]propan-2-amine
SMILESCc1cncc(C(C)NC(C)(C)C)c1
InChIInChI=1S/C12H20N2/c1-9-6-11(8-13-7-9)10(2)14-12(3,4)5/h6-8,10,14H,1-5H3
InChIKeyNSGYMHYGPPULLH-UHFFFAOYSA-N
MW192.31 g/mol
LogP2.84
Rot. Bonds2

About 2-methyl-N-[1-(5-methyl-3-pyridinyl)ethyl]propan-2-amine

2-methyl-N-[1-(5-methyl-3-pyridinyl)ethyl]propan-2-amine (PubChem CID 130660349) has the molecular formula C12H20N2 and a molecular weight of 192.31 g/mol. Its IUPAC name is 2-methyl-N-[1-(5-methyl-3-pyridinyl)ethyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[1-(5-methyl-3-pyridinyl)ethyl]propan-2-amine
PubChem CID130660349
Molecular FormulaC12H20N2
Molecular Weight192.31 g/mol
Exact Mass192.16
IUPAC Name2-methyl-N-[1-(5-methyl-3-pyridinyl)ethyl]propan-2-amine
SMILESCc1cncc(C(C)NC(C)(C)C)c1
InChIInChI=1S/C12H20N2/c1-9-6-11(8-13-7-9)10(2)14-12(3,4)5/h6-8,10,14H,1-5H3
InChIKeyNSGYMHYGPPULLH-UHFFFAOYSA-N
XLogP2.84
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.31
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[1-(5-methyl-3-pyridinyl)ethyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[1-(5-methyl-3-pyridinyl)ethyl]propan-2-amine (CID 130660349) is 2-methyl-N-[1-(5-methyl-3-pyridinyl)ethyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[1-(5-methyl-3-pyridinyl)ethyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[1-(5-methyl-3-pyridinyl)ethyl]propan-2-amine is Cc1cncc(C(C)NC(C)(C)C)c1.
What is the InChIKey of 2-methyl-N-[1-(5-methyl-3-pyridinyl)ethyl]propan-2-amine?
The InChIKey is NSGYMHYGPPULLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2/c1-9-6-11(8-13-7-9)10(2)14-12(3,4)5/h6-8,10,14H,1-5H3.
What are the key properties of 2-methyl-N-[1-(5-methyl-3-pyridinyl)ethyl]propan-2-amine?
2-methyl-N-[1-(5-methyl-3-pyridinyl)ethyl]propan-2-amine has a molecular weight of 192.31 g/mol, XLogP of 2.84, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[1-(5-methyl-3-pyridinyl)ethyl]propan-2-amine is sourced from PubChem (CID 130660349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).