4-chloro-6-morpholin-4-yl-N-(1H-pyrazol-5-ylmethyl)-1,3,5-triazin-2-amine

C11H14ClN7O — CID 106194336

IUPAC4-chloro-6-morpholin-4-yl-N-(1H-pyrazol-5-ylmethyl)-1,3,5-triazin-2-amine
SMILESClc1nc(NCc2ccn[nH]2)nc(N2CCOCC2)n1
InChIInChI=1S/C11H14ClN7O/c12-9-15-10(13-7-8-1-2-14-18-8)17-11(16-9)19-3-5-20-6-4-19/h1-2H,3-7H2,(H,14,18)(H,13,15,16,17)
InChIKeyZYEBLCRJUTZWBL-UHFFFAOYSA-N
MW295.73 g/mol
LogP0.70
Rot. Bonds4

About 4-chloro-6-morpholin-4-yl-N-(1H-pyrazol-5-ylmethyl)-1,3,5-triazin-2-amine

4-chloro-6-morpholin-4-yl-N-(1H-pyrazol-5-ylmethyl)-1,3,5-triazin-2-amine (PubChem CID 106194336) has the molecular formula C11H14ClN7O and a molecular weight of 295.73 g/mol. Its IUPAC name is 4-chloro-6-morpholin-4-yl-N-(1H-pyrazol-5-ylmethyl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-chloro-6-morpholin-4-yl-N-(1H-pyrazol-5-ylmethyl)-1,3,5-triazin-2-amine
PubChem CID106194336
Molecular FormulaC11H14ClN7O
Molecular Weight295.73 g/mol
Exact Mass295.09
IUPAC Name4-chloro-6-morpholin-4-yl-N-(1H-pyrazol-5-ylmethyl)-1,3,5-triazin-2-amine
SMILESClc1nc(NCc2ccn[nH]2)nc(N2CCOCC2)n1
InChIInChI=1S/C11H14ClN7O/c12-9-15-10(13-7-8-1-2-14-18-8)17-11(16-9)19-3-5-20-6-4-19/h1-2H,3-7H2,(H,14,18)(H,13,15,16,17)
InChIKeyZYEBLCRJUTZWBL-UHFFFAOYSA-N
XLogP0.70
TPSA91.85 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.73
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 4-chloro-6-morpholin-4-yl-N-(1H-pyrazol-5-ylmethyl)-1,3,5-triazin-2-amine with MolForge

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Related Compounds

4-chloro-N-[(5-methylfuran-2-yl)methyl]-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 62864878
4-chloro-6-morpholin-4-yl-N-(2-pyridin-3-ylethyl)-1,3,5-triazin-2-amine
CID 58508232
4-chloro-N-(2-methoxyethyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 62868206
1-[(4-chloro-6-morpholin-4-yl-1,3,5-triazin-2-yl)amino]propan-2-ol
CID 55125040
4-chloro-N-(4-fluorophenyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 23381719
N-(2-bromoprop-2-enyl)-4-chloro-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 114156784
1-[(4-chloro-6-morpholin-4-yl-1,3,5-triazin-2-yl)amino]butan-2-ol
CID 113492552
4-chloro-N-(2,2-dimethoxyethyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 106197141
4-[(4-chloro-6-morpholin-4-yl-1,3,5-triazin-2-yl)amino]butan-2-ol
CID 64913356
4-chloro-6-morpholin-4-yl-N-pent-4-ynyl-1,3,5-triazin-2-amine
CID 114160296
2-[(4-chloro-6-morpholin-4-yl-1,3,5-triazin-2-yl)amino]-N-propan-2-ylacetamide
CID 62864568
4-chloro-6-morpholin-4-yl-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazin-2-amine
CID 139072586

Frequently Asked Questions

What is the IUPAC name of 4-chloro-6-morpholin-4-yl-N-(1H-pyrazol-5-ylmethyl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-chloro-6-morpholin-4-yl-N-(1H-pyrazol-5-ylmethyl)-1,3,5-triazin-2-amine (CID 106194336) is 4-chloro-6-morpholin-4-yl-N-(1H-pyrazol-5-ylmethyl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-chloro-6-morpholin-4-yl-N-(1H-pyrazol-5-ylmethyl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-chloro-6-morpholin-4-yl-N-(1H-pyrazol-5-ylmethyl)-1,3,5-triazin-2-amine is Clc1nc(NCc2ccn[nH]2)nc(N2CCOCC2)n1.
What is the InChIKey of 4-chloro-6-morpholin-4-yl-N-(1H-pyrazol-5-ylmethyl)-1,3,5-triazin-2-amine?
The InChIKey is ZYEBLCRJUTZWBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClN7O/c12-9-15-10(13-7-8-1-2-14-18-8)17-11(16-9)19-3-5-20-6-4-19/h1-2H,3-7H2,(H,14,18)(H,13,15,16,17).
What are the key properties of 4-chloro-6-morpholin-4-yl-N-(1H-pyrazol-5-ylmethyl)-1,3,5-triazin-2-amine?
4-chloro-6-morpholin-4-yl-N-(1H-pyrazol-5-ylmethyl)-1,3,5-triazin-2-amine has a molecular weight of 295.73 g/mol, XLogP of 0.70, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6-morpholin-4-yl-N-(1H-pyrazol-5-ylmethyl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 106194336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).