[1-[4-(dimethylamino)-6-(ethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol

C13H24N6O — CID 80793310

IUPAC[1-[4-(dimethylamino)-6-(ethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol
SMILESCCNc1nc(N(C)C)nc(N2CCCC(CO)C2)n1
InChIInChI=1S/C13H24N6O/c1-4-14-11-15-12(18(2)3)17-13(16-11)19-7-5-6-10(8-19)9-20/h10,20H,4-9H2,1-3H3,(H,14,15,16,17)
InChIKeyYSGKKLVQBWYNMY-UHFFFAOYSA-N
MW280.38 g/mol
LogP0.58
Rot. Bonds5

About [1-[4-(dimethylamino)-6-(ethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol

[1-[4-(dimethylamino)-6-(ethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol (PubChem CID 80793310) has the molecular formula C13H24N6O and a molecular weight of 280.38 g/mol. Its IUPAC name is [1-[4-(dimethylamino)-6-(ethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol.

Molecular Properties

Compound Name[1-[4-(dimethylamino)-6-(ethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol
PubChem CID80793310
Molecular FormulaC13H24N6O
Molecular Weight280.38 g/mol
Exact Mass280.20
IUPAC Name[1-[4-(dimethylamino)-6-(ethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol
SMILESCCNc1nc(N(C)C)nc(N2CCCC(CO)C2)n1
InChIInChI=1S/C13H24N6O/c1-4-14-11-15-12(18(2)3)17-13(16-11)19-7-5-6-10(8-19)9-20/h10,20H,4-9H2,1-3H3,(H,14,15,16,17)
InChIKeyYSGKKLVQBWYNMY-UHFFFAOYSA-N
XLogP0.58
TPSA77.41 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.38
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

[1-[4-(dimethylamino)-6-(ethylamino)-1,3,5-triazin-2-yl]pyrrolidin-2-yl]methanol
CID 80794784
1-[4-[4-(dimethylamino)-6-(ethylamino)-1,3,5-triazin-2-yl]piperazin-1-yl]ethanone
CID 80751565
6-(3,4-dimethoxypyrrolidin-1-yl)-2-N-ethyl-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 103542047
2-[1-[4-ethoxy-6-(ethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]ethanol
CID 107229222
4-N-cyclopropyl-2-N-ethyl-4-N-methyl-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine
CID 80775644
1-[4-(dimethylamino)-6-hydrazinyl-1,3,5-triazin-2-yl]piperidin-3-ol
CID 80906673
2-N-ethyl-4-N,4-N-dimethyl-6-(1-oxo-1,4-thiazinan-4-yl)-1,3,5-triazine-2,4-diamine
CID 80805026
6-N-ethyl-2-N,4-N,4-N-trimethyl-2-N-(1-methylpiperidin-3-yl)-1,3,5-triazine-2,4,6-triamine
CID 80803845
6-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)-2-N-ethyl-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 82752442
N-ethyl-4-(3-methylpyrrolidin-1-yl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine
CID 80797845
[1-[4-(diethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol
CID 57067375
2-N-(cyclopentylmethyl)-4-N-ethyl-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine
CID 80772042

Frequently Asked Questions

What is the IUPAC name of [1-[4-(dimethylamino)-6-(ethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol?
The IUPAC name of [1-[4-(dimethylamino)-6-(ethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol (CID 80793310) is [1-[4-(dimethylamino)-6-(ethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol.
What is the SMILES notation for [1-[4-(dimethylamino)-6-(ethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol?
The canonical SMILES for [1-[4-(dimethylamino)-6-(ethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol is CCNc1nc(N(C)C)nc(N2CCCC(CO)C2)n1.
What is the InChIKey of [1-[4-(dimethylamino)-6-(ethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol?
The InChIKey is YSGKKLVQBWYNMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N6O/c1-4-14-11-15-12(18(2)3)17-13(16-11)19-7-5-6-10(8-19)9-20/h10,20H,4-9H2,1-3H3,(H,14,15,16,17).
What are the key properties of [1-[4-(dimethylamino)-6-(ethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol?
[1-[4-(dimethylamino)-6-(ethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol has a molecular weight of 280.38 g/mol, XLogP of 0.58, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[4-(dimethylamino)-6-(ethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol is sourced from PubChem (CID 80793310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).