1-[4-[(4-amino-2-pyridinyl)methyl]piperazin-1-yl]-2-methylpropan-2-ol

C14H24N4O — CID 79251536

IUPAC1-[4-[(4-amino-2-pyridinyl)methyl]piperazin-1-yl]-2-methylpropan-2-ol
SMILESCC(C)(O)CN1CCN(Cc2cc(N)ccn2)CC1
InChIInChI=1S/C14H24N4O/c1-14(2,19)11-18-7-5-17(6-8-18)10-13-9-12(15)3-4-16-13/h3-4,9,19H,5-8,10-11H2,1-2H3,(H2,15,16)
InChIKeyFOORGEHVYRIBEG-UHFFFAOYSA-N
MW264.37 g/mol
LogP0.55
Rot. Bonds4

About 1-[4-[(4-amino-2-pyridinyl)methyl]piperazin-1-yl]-2-methylpropan-2-ol

1-[4-[(4-amino-2-pyridinyl)methyl]piperazin-1-yl]-2-methylpropan-2-ol (PubChem CID 79251536) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 1-[4-[(4-amino-2-pyridinyl)methyl]piperazin-1-yl]-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-[4-[(4-amino-2-pyridinyl)methyl]piperazin-1-yl]-2-methylpropan-2-ol
PubChem CID79251536
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name1-[4-[(4-amino-2-pyridinyl)methyl]piperazin-1-yl]-2-methylpropan-2-ol
SMILESCC(C)(O)CN1CCN(Cc2cc(N)ccn2)CC1
InChIInChI=1S/C14H24N4O/c1-14(2,19)11-18-7-5-17(6-8-18)10-13-9-12(15)3-4-16-13/h3-4,9,19H,5-8,10-11H2,1-2H3,(H2,15,16)
InChIKeyFOORGEHVYRIBEG-UHFFFAOYSA-N
XLogP0.55
TPSA65.62 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(azepan-1-ylmethyl)pyridin-4-amine
CID 79244961
2-[(4,4-dimethylpiperidin-1-yl)methyl]pyridin-4-amine
CID 79251522
ethyl 4-[(4-amino-2-pyridinyl)methyl]piperazine-1-carboxylate
CID 107877724
2-(8-azaspiro[4.5]decan-8-ylmethyl)pyridin-4-amine
CID 79251942
2-[(4,4-dimethylazepan-1-yl)methyl]pyridin-4-amine
CID 79251366
1-[4-[(3-amino-5-bromophenyl)methyl]piperazin-1-yl]-2-methylpropan-2-ol
CID 103349981
methyl 1-[(4-amino-2-pyridinyl)methyl]piperidine-4-carboxylate
CID 79245399
1-[4-[(6-chloro-2-pyridinyl)methyl]piperazin-1-yl]-2-methylpropan-2-ol
CID 79038456
4-[(4-amino-2-pyridinyl)methyl]-1-ethylpiperazine-2-carbaldehyde
CID 174610895
2-[1-[(4-amino-2-pyridinyl)methyl]pyrrolidin-3-yl]ethanol
CID 114799922
1-[4-[(2-chloro-3-pyridinyl)methyl]piperazin-1-yl]-2-methylpropan-2-ol
CID 63103864
1-[4-[(2-amino-4-bromophenyl)methyl]piperazin-1-yl]-2-methylpropan-2-ol
CID 114380449

Frequently Asked Questions

What is the IUPAC name of 1-[4-[(4-amino-2-pyridinyl)methyl]piperazin-1-yl]-2-methylpropan-2-ol?
The IUPAC name of 1-[4-[(4-amino-2-pyridinyl)methyl]piperazin-1-yl]-2-methylpropan-2-ol (CID 79251536) is 1-[4-[(4-amino-2-pyridinyl)methyl]piperazin-1-yl]-2-methylpropan-2-ol.
What is the SMILES notation for 1-[4-[(4-amino-2-pyridinyl)methyl]piperazin-1-yl]-2-methylpropan-2-ol?
The canonical SMILES for 1-[4-[(4-amino-2-pyridinyl)methyl]piperazin-1-yl]-2-methylpropan-2-ol is CC(C)(O)CN1CCN(Cc2cc(N)ccn2)CC1.
What is the InChIKey of 1-[4-[(4-amino-2-pyridinyl)methyl]piperazin-1-yl]-2-methylpropan-2-ol?
The InChIKey is FOORGEHVYRIBEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-14(2,19)11-18-7-5-17(6-8-18)10-13-9-12(15)3-4-16-13/h3-4,9,19H,5-8,10-11H2,1-2H3,(H2,15,16).
What are the key properties of 1-[4-[(4-amino-2-pyridinyl)methyl]piperazin-1-yl]-2-methylpropan-2-ol?
1-[4-[(4-amino-2-pyridinyl)methyl]piperazin-1-yl]-2-methylpropan-2-ol has a molecular weight of 264.37 g/mol, XLogP of 0.55, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[(4-amino-2-pyridinyl)methyl]piperazin-1-yl]-2-methylpropan-2-ol is sourced from PubChem (CID 79251536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).