4-methyl-3-(5-methyl-2-pyridinyl)pentan-2-amine

C12H20N2 — CID 63197672

IUPAC4-methyl-3-(5-methyl-2-pyridinyl)pentan-2-amine
SMILESCc1ccc(C(C(C)C)C(C)N)nc1
InChIInChI=1S/C12H20N2/c1-8(2)12(10(4)13)11-6-5-9(3)7-14-11/h5-8,10,12H,13H2,1-4H3
InChIKeyBAHNXJCXPGOTDZ-UHFFFAOYSA-N
MW192.31 g/mol
LogP2.48
Rot. Bonds3

About 4-methyl-3-(5-methyl-2-pyridinyl)pentan-2-amine

4-methyl-3-(5-methyl-2-pyridinyl)pentan-2-amine (PubChem CID 63197672) has the molecular formula C12H20N2 and a molecular weight of 192.31 g/mol. Its IUPAC name is 4-methyl-3-(5-methyl-2-pyridinyl)pentan-2-amine.

Molecular Properties

Compound Name4-methyl-3-(5-methyl-2-pyridinyl)pentan-2-amine
PubChem CID63197672
Molecular FormulaC12H20N2
Molecular Weight192.31 g/mol
Exact Mass192.16
IUPAC Name4-methyl-3-(5-methyl-2-pyridinyl)pentan-2-amine
SMILESCc1ccc(C(C(C)C)C(C)N)nc1
InChIInChI=1S/C12H20N2/c1-8(2)12(10(4)13)11-6-5-9(3)7-14-11/h5-8,10,12H,13H2,1-4H3
InChIKeyBAHNXJCXPGOTDZ-UHFFFAOYSA-N
XLogP2.48
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.31
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-(5-methyl-2-pyridinyl)pentan-2-amine?
The IUPAC name of 4-methyl-3-(5-methyl-2-pyridinyl)pentan-2-amine (CID 63197672) is 4-methyl-3-(5-methyl-2-pyridinyl)pentan-2-amine.
What is the SMILES notation for 4-methyl-3-(5-methyl-2-pyridinyl)pentan-2-amine?
The canonical SMILES for 4-methyl-3-(5-methyl-2-pyridinyl)pentan-2-amine is Cc1ccc(C(C(C)C)C(C)N)nc1.
What is the InChIKey of 4-methyl-3-(5-methyl-2-pyridinyl)pentan-2-amine?
The InChIKey is BAHNXJCXPGOTDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2/c1-8(2)12(10(4)13)11-6-5-9(3)7-14-11/h5-8,10,12H,13H2,1-4H3.
What are the key properties of 4-methyl-3-(5-methyl-2-pyridinyl)pentan-2-amine?
4-methyl-3-(5-methyl-2-pyridinyl)pentan-2-amine has a molecular weight of 192.31 g/mol, XLogP of 2.48, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-(5-methyl-2-pyridinyl)pentan-2-amine is sourced from PubChem (CID 63197672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).