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

C13H22N2 — CID 105126712

IUPACN,4-dimethyl-1-(2-methyl-3-pyridinyl)pentan-1-amine
SMILESCNC(CCC(C)C)c1cccnc1C
InChIInChI=1S/C13H22N2/c1-10(2)7-8-13(14-4)12-6-5-9-15-11(12)3/h5-6,9-10,13-14H,7-8H2,1-4H3
InChIKeyKHLQIWWIYFJKAJ-UHFFFAOYSA-N
MW206.33 g/mol
LogP3.09
Rot. Bonds5

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

N,4-dimethyl-1-(2-methyl-3-pyridinyl)pentan-1-amine (PubChem CID 105126712) has the molecular formula C13H22N2 and a molecular weight of 206.33 g/mol. Its IUPAC name is N,4-dimethyl-1-(2-methyl-3-pyridinyl)pentan-1-amine.

Molecular Properties

Compound NameN,4-dimethyl-1-(2-methyl-3-pyridinyl)pentan-1-amine
PubChem CID105126712
Molecular FormulaC13H22N2
Molecular Weight206.33 g/mol
Exact Mass206.18
IUPAC NameN,4-dimethyl-1-(2-methyl-3-pyridinyl)pentan-1-amine
SMILESCNC(CCC(C)C)c1cccnc1C
InChIInChI=1S/C13H22N2/c1-10(2)7-8-13(14-4)12-6-5-9-15-11(12)3/h5-6,9-10,13-14H,7-8H2,1-4H3
InChIKeyKHLQIWWIYFJKAJ-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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Related Compounds

N-methyl-1-(2-methyl-3-pyridinyl)octan-1-amine
CID 105124578
1-(2-fluoro-3-methylphenyl)-N,4-dimethylpentan-1-amine
CID 115834345
2-(3-chlorophenyl)-N-methyl-1-(2-methyl-3-pyridinyl)ethanamine
CID 105085790
3-(1-hydrazinyl-4-methylpentyl)pyridin-2-amine
CID 105207559
N-methyl-1-quinolin-8-ylpent-4-yn-1-amine
CID 105148985
2-(4-chloro-2-fluorophenyl)-N-methyl-1-(2-methyl-3-pyridinyl)ethanamine
CID 105190365
ethane;2-methyl-3-propan-2-ylpyridine
CID 142858508
N-ethyl-1-(2-methyl-3-pyridinyl)ethanamine
CID 105082350
3-methyl-1-(2-methyl-3-pyridinyl)butan-1-ol
CID 105076232
(1S)-1-(2-methyl-3-pyridinyl)ethanamine
CID 94864826
ethane;2-methyl-3-propan-2-ylpyridine;vanadium
CID 143650392
N-methyl-1-(2-methyl-3-pyridinyl)-2-quinolin-2-ylethanamine
CID 105159170

Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-1-(2-methyl-3-pyridinyl)pentan-1-amine?
The IUPAC name of N,4-dimethyl-1-(2-methyl-3-pyridinyl)pentan-1-amine (CID 105126712) is N,4-dimethyl-1-(2-methyl-3-pyridinyl)pentan-1-amine.
What is the SMILES notation for N,4-dimethyl-1-(2-methyl-3-pyridinyl)pentan-1-amine?
The canonical SMILES for N,4-dimethyl-1-(2-methyl-3-pyridinyl)pentan-1-amine is CNC(CCC(C)C)c1cccnc1C.
What is the InChIKey of N,4-dimethyl-1-(2-methyl-3-pyridinyl)pentan-1-amine?
The InChIKey is KHLQIWWIYFJKAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2/c1-10(2)7-8-13(14-4)12-6-5-9-15-11(12)3/h5-6,9-10,13-14H,7-8H2,1-4H3.
What are the key properties of N,4-dimethyl-1-(2-methyl-3-pyridinyl)pentan-1-amine?
N,4-dimethyl-1-(2-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,4-dimethyl-1-(2-methyl-3-pyridinyl)pentan-1-amine is sourced from PubChem (CID 105126712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).