4-pyridin-4-ylpentan-2-amine

C10H16N2 — CID 112714269

IUPAC4-pyridin-4-ylpentan-2-amine
SMILESCC(N)CC(C)c1ccncc1
InChIInChI=1S/C10H16N2/c1-8(7-9(2)11)10-3-5-12-6-4-10/h3-6,8-9H,7,11H2,1-2H3
InChIKeyMWFGBHULGQEFTK-UHFFFAOYSA-N
MW164.25 g/mol
LogP1.92
Rot. Bonds3

About 4-pyridin-4-ylpentan-2-amine

4-pyridin-4-ylpentan-2-amine (PubChem CID 112714269) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is 4-pyridin-4-ylpentan-2-amine.

Molecular Properties

Compound Name4-pyridin-4-ylpentan-2-amine
PubChem CID112714269
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name4-pyridin-4-ylpentan-2-amine
SMILESCC(N)CC(C)c1ccncc1
InChIInChI=1S/C10H16N2/c1-8(7-9(2)11)10-3-5-12-6-4-10/h3-6,8-9H,7,11H2,1-2H3
InChIKeyMWFGBHULGQEFTK-UHFFFAOYSA-N
XLogP1.92
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S,4R)-4-(4-methylphenyl)pentan-2-amine
CID 11789769
4-(1-ethyl-3-pyridin-4-ylbutyl)pyridine
CID 18346387
2-pyridin-4-ylpropane-1-thiol
CID 146504798
4-[(2S)-pentan-2-yl]pyridine
CID 166675231
4-(4-phenylphenyl)pentan-2-amine
CID 65456648
(1S)-1-pyridin-4-ylpropan-1-amine
CID 26722519
ethane;molecular hydrogen;(1S)-1-pyridin-4-ylethanamine
CID 142237918
4-pyrazin-2-ylpentan-2-amine
CID 64721175
(1R)-4-methyl-1-pyridin-4-ylpentan-1-amine;hydrochloride
CID 171200288
(1R)-2-methyl-1-pyridin-4-ylbutan-1-amine;hydrochloride
CID 171200287
4-(2,6-diphenyloctan-4-yl)pyridine;methane
CID 157478380
4-(3-methylphenyl)pentan-2-amine
CID 64719404

Frequently Asked Questions

What is the IUPAC name of 4-pyridin-4-ylpentan-2-amine?
The IUPAC name of 4-pyridin-4-ylpentan-2-amine (CID 112714269) is 4-pyridin-4-ylpentan-2-amine.
What is the SMILES notation for 4-pyridin-4-ylpentan-2-amine?
The canonical SMILES for 4-pyridin-4-ylpentan-2-amine is CC(N)CC(C)c1ccncc1.
What is the InChIKey of 4-pyridin-4-ylpentan-2-amine?
The InChIKey is MWFGBHULGQEFTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c1-8(7-9(2)11)10-3-5-12-6-4-10/h3-6,8-9H,7,11H2,1-2H3.
What are the key properties of 4-pyridin-4-ylpentan-2-amine?
4-pyridin-4-ylpentan-2-amine has a molecular weight of 164.25 g/mol, XLogP of 1.92, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pyridin-4-ylpentan-2-amine is sourced from PubChem (CID 112714269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).