N,2-dimethyl-1-(4-methyl-3-pyridinyl)pentan-1-amine

C13H22N2 — CID 105006266

IUPACN,2-dimethyl-1-(4-methyl-3-pyridinyl)pentan-1-amine
SMILESCCCC(C)C(NC)c1cnccc1C
InChIInChI=1S/C13H22N2/c1-5-6-11(3)13(14-4)12-9-15-8-7-10(12)2/h7-9,11,13-14H,5-6H2,1-4H3
InChIKeyQAPZSSOZCLTOMH-UHFFFAOYSA-N
MW206.33 g/mol
LogP3.09
Rot. Bonds5

About N,2-dimethyl-1-(4-methyl-3-pyridinyl)pentan-1-amine

N,2-dimethyl-1-(4-methyl-3-pyridinyl)pentan-1-amine (PubChem CID 105006266) has the molecular formula C13H22N2 and a molecular weight of 206.33 g/mol. Its IUPAC name is N,2-dimethyl-1-(4-methyl-3-pyridinyl)pentan-1-amine.

Molecular Properties

Compound NameN,2-dimethyl-1-(4-methyl-3-pyridinyl)pentan-1-amine
PubChem CID105006266
Molecular FormulaC13H22N2
Molecular Weight206.33 g/mol
Exact Mass206.18
IUPAC NameN,2-dimethyl-1-(4-methyl-3-pyridinyl)pentan-1-amine
SMILESCCCC(C)C(NC)c1cnccc1C
InChIInChI=1S/C13H22N2/c1-5-6-11(3)13(14-4)12-9-15-8-7-10(12)2/h7-9,11,13-14H,5-6H2,1-4H3
InChIKeyQAPZSSOZCLTOMH-UHFFFAOYSA-N
XLogP3.09
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.33
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-1-(4-methyl-3-pyridinyl)pentan-1-amine?
The IUPAC name of N,2-dimethyl-1-(4-methyl-3-pyridinyl)pentan-1-amine (CID 105006266) is N,2-dimethyl-1-(4-methyl-3-pyridinyl)pentan-1-amine.
What is the SMILES notation for N,2-dimethyl-1-(4-methyl-3-pyridinyl)pentan-1-amine?
The canonical SMILES for N,2-dimethyl-1-(4-methyl-3-pyridinyl)pentan-1-amine is CCCC(C)C(NC)c1cnccc1C.
What is the InChIKey of N,2-dimethyl-1-(4-methyl-3-pyridinyl)pentan-1-amine?
The InChIKey is QAPZSSOZCLTOMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2/c1-5-6-11(3)13(14-4)12-9-15-8-7-10(12)2/h7-9,11,13-14H,5-6H2,1-4H3.
What are the key properties of N,2-dimethyl-1-(4-methyl-3-pyridinyl)pentan-1-amine?
N,2-dimethyl-1-(4-methyl-3-pyridinyl)pentan-1-amine has a molecular weight of 206.33 g/mol, XLogP of 3.09, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-1-(4-methyl-3-pyridinyl)pentan-1-amine is sourced from PubChem (CID 105006266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).