1-(2-amino-5-methyl-3-pyridinyl)-2-(1,4-dimethylpiperazin-2-yl)ethanol

C14H24N4O — CID 115414904

IUPAC1-(2-amino-5-methyl-3-pyridinyl)-2-(1,4-dimethylpiperazin-2-yl)ethanol
SMILESCc1cnc(N)c(C(O)CC2CN(C)CCN2C)c1
InChIInChI=1S/C14H24N4O/c1-10-6-12(14(15)16-8-10)13(19)7-11-9-17(2)4-5-18(11)3/h6,8,11,13,19H,4-5,7,9H2,1-3H3,(H2,15,16)
InChIKeyPHUURBLVTIFMQS-UHFFFAOYSA-N
MW264.37 g/mol
LogP0.64
Rot. Bonds3

About 1-(2-amino-5-methyl-3-pyridinyl)-2-(1,4-dimethylpiperazin-2-yl)ethanol

1-(2-amino-5-methyl-3-pyridinyl)-2-(1,4-dimethylpiperazin-2-yl)ethanol (PubChem CID 115414904) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 1-(2-amino-5-methyl-3-pyridinyl)-2-(1,4-dimethylpiperazin-2-yl)ethanol.

Molecular Properties

Compound Name1-(2-amino-5-methyl-3-pyridinyl)-2-(1,4-dimethylpiperazin-2-yl)ethanol
PubChem CID115414904
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name1-(2-amino-5-methyl-3-pyridinyl)-2-(1,4-dimethylpiperazin-2-yl)ethanol
SMILESCc1cnc(N)c(C(O)CC2CN(C)CCN2C)c1
InChIInChI=1S/C14H24N4O/c1-10-6-12(14(15)16-8-10)13(19)7-11-9-17(2)4-5-18(11)3/h6,8,11,13,19H,4-5,7,9H2,1-3H3,(H2,15,16)
InChIKeyPHUURBLVTIFMQS-UHFFFAOYSA-N
XLogP0.64
TPSA65.62 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 50.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-(4-amino-3-pyridinyl)-2-(1,4-dimethylpiperazin-2-yl)ethanol
CID 113305466
2-(1,4-dimethylpiperazin-2-yl)-1-(5-methyl-3-pyridinyl)ethanamine
CID 113305498
2-(1,4-dimethylpiperazin-2-yl)-1-(5-fluoro-2-methylphenyl)ethanol
CID 115414890
2-(1,4-dimethylpiperazin-2-yl)-1-(3-fluoro-4-pyridinyl)ethanol
CID 104738104
1-(2-amino-5-methyl-3-pyridinyl)-4-chlorobutan-1-ol
CID 66046118
1-(2-amino-5-methyl-3-pyridinyl)-4-methoxybutan-1-ol
CID 65092617
3-(1-amino-2-cyclopropylethyl)-5-methylpyridin-2-amine
CID 55295743
1-(2-amino-5-methyl-3-pyridinyl)-3-(dimethylamino)propan-1-ol
CID 115345867
2-(1,4-dimethylpiperazin-2-yl)-1-pyridin-3-ylethanol
CID 113305480
(2-amino-5-methyl-3-pyridinyl)-(1,4-dimethylpiperazin-2-yl)methanone
CID 79658548
3-[(1,4-dimethyl-1,4-diazepan-2-yl)-hydrazinylmethyl]-5-methylpyridin-2-amine
CID 105261374
(2-amino-5-methyl-3-pyridinyl)-(4-methylthiomorpholin-3-yl)methanol
CID 103595651

Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-5-methyl-3-pyridinyl)-2-(1,4-dimethylpiperazin-2-yl)ethanol?
The IUPAC name of 1-(2-amino-5-methyl-3-pyridinyl)-2-(1,4-dimethylpiperazin-2-yl)ethanol (CID 115414904) is 1-(2-amino-5-methyl-3-pyridinyl)-2-(1,4-dimethylpiperazin-2-yl)ethanol.
What is the SMILES notation for 1-(2-amino-5-methyl-3-pyridinyl)-2-(1,4-dimethylpiperazin-2-yl)ethanol?
The canonical SMILES for 1-(2-amino-5-methyl-3-pyridinyl)-2-(1,4-dimethylpiperazin-2-yl)ethanol is Cc1cnc(N)c(C(O)CC2CN(C)CCN2C)c1.
What is the InChIKey of 1-(2-amino-5-methyl-3-pyridinyl)-2-(1,4-dimethylpiperazin-2-yl)ethanol?
The InChIKey is PHUURBLVTIFMQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-10-6-12(14(15)16-8-10)13(19)7-11-9-17(2)4-5-18(11)3/h6,8,11,13,19H,4-5,7,9H2,1-3H3,(H2,15,16).
What are the key properties of 1-(2-amino-5-methyl-3-pyridinyl)-2-(1,4-dimethylpiperazin-2-yl)ethanol?
1-(2-amino-5-methyl-3-pyridinyl)-2-(1,4-dimethylpiperazin-2-yl)ethanol has a molecular weight of 264.37 g/mol, XLogP of 0.64, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-5-methyl-3-pyridinyl)-2-(1,4-dimethylpiperazin-2-yl)ethanol is sourced from PubChem (CID 115414904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).