N,5-dimethyl-2-pyridin-4-ylhexan-3-amine

C13H22N2 — CID 66447939

IUPACN,5-dimethyl-2-pyridin-4-ylhexan-3-amine
SMILESCNC(CC(C)C)C(C)c1ccncc1
InChIInChI=1S/C13H22N2/c1-10(2)9-13(14-4)11(3)12-5-7-15-8-6-12/h5-8,10-11,13-14H,9H2,1-4H3
InChIKeyXWOZTNHSOQSMFT-UHFFFAOYSA-N
MW206.33 g/mol
LogP2.82
Rot. Bonds5

About N,5-dimethyl-2-pyridin-4-ylhexan-3-amine

N,5-dimethyl-2-pyridin-4-ylhexan-3-amine (PubChem CID 66447939) has the molecular formula C13H22N2 and a molecular weight of 206.33 g/mol. Its IUPAC name is N,5-dimethyl-2-pyridin-4-ylhexan-3-amine.

Molecular Properties

Compound NameN,5-dimethyl-2-pyridin-4-ylhexan-3-amine
PubChem CID66447939
Molecular FormulaC13H22N2
Molecular Weight206.33 g/mol
Exact Mass206.18
IUPAC NameN,5-dimethyl-2-pyridin-4-ylhexan-3-amine
SMILESCNC(CC(C)C)C(C)c1ccncc1
InChIInChI=1S/C13H22N2/c1-10(2)9-13(14-4)11(3)12-5-7-15-8-6-12/h5-8,10-11,13-14H,9H2,1-4H3
InChIKeyXWOZTNHSOQSMFT-UHFFFAOYSA-N
XLogP2.82
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 ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,5-dimethyl-2-pyridin-4-ylheptan-3-amine
CID 114875188
N-methyl-1,2-dipyridin-4-ylpropan-1-amine
CID 66446384
1-cyclobutyl-N-methyl-3-pyridin-4-ylbutan-2-amine
CID 103164322
1-cycloheptyl-N-methyl-3-pyridin-4-ylbutan-2-amine
CID 114458229
N-methyl-1-phenyl-2-pyridin-4-ylpropan-1-amine
CID 66446573
N,5-dimethyl-4-propan-2-yl-2-pyridin-4-ylhexan-3-amine
CID 114282261
6-methyl-2-pyridin-4-ylheptan-3-ol
CID 66460886
N,4-dimethyl-1-pyridin-4-ylpentan-1-amine
CID 62600732
N-methyl-1-pyridin-4-ylethanamine;dihydrochloride
CID 42921481
1-(methylamino)-1-pyridin-4-ylpropan-2-ol
CID 116859507
N-ethyl-3-methyl-1-pyridin-4-ylbutan-1-amine
CID 60820218
N-methyl-1-(3-methylfuran-2-yl)-2-pyridin-4-ylpropan-1-amine
CID 66448517

Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-2-pyridin-4-ylhexan-3-amine?
The IUPAC name of N,5-dimethyl-2-pyridin-4-ylhexan-3-amine (CID 66447939) is N,5-dimethyl-2-pyridin-4-ylhexan-3-amine.
What is the SMILES notation for N,5-dimethyl-2-pyridin-4-ylhexan-3-amine?
The canonical SMILES for N,5-dimethyl-2-pyridin-4-ylhexan-3-amine is CNC(CC(C)C)C(C)c1ccncc1.
What is the InChIKey of N,5-dimethyl-2-pyridin-4-ylhexan-3-amine?
The InChIKey is XWOZTNHSOQSMFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2/c1-10(2)9-13(14-4)11(3)12-5-7-15-8-6-12/h5-8,10-11,13-14H,9H2,1-4H3.
What are the key properties of N,5-dimethyl-2-pyridin-4-ylhexan-3-amine?
N,5-dimethyl-2-pyridin-4-ylhexan-3-amine has a molecular weight of 206.33 g/mol, XLogP of 2.82, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-2-pyridin-4-ylhexan-3-amine is sourced from PubChem (CID 66447939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).