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

C12H18ClN5O — CID 55124915

IUPAC4-chloro-N-(2,2-dimethylcyclopropyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
SMILESCC1(C)CC1Nc1nc(Cl)nc(N2CCOCC2)n1
InChIInChI=1S/C12H18ClN5O/c1-12(2)7-8(12)14-10-15-9(13)16-11(17-10)18-3-5-19-6-4-18/h8H,3-7H2,1-2H3,(H,14,15,16,17)
InChIKeyHZFJTLZDAWUTGP-UHFFFAOYSA-N
MW283.76 g/mol
LogP1.57
Rot. Bonds3

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

4-chloro-N-(2,2-dimethylcyclopropyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine (PubChem CID 55124915) has the molecular formula C12H18ClN5O and a molecular weight of 283.76 g/mol. Its IUPAC name is 4-chloro-N-(2,2-dimethylcyclopropyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-chloro-N-(2,2-dimethylcyclopropyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
PubChem CID55124915
Molecular FormulaC12H18ClN5O
Molecular Weight283.76 g/mol
Exact Mass283.12
IUPAC Name4-chloro-N-(2,2-dimethylcyclopropyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
SMILESCC1(C)CC1Nc1nc(Cl)nc(N2CCOCC2)n1
InChIInChI=1S/C12H18ClN5O/c1-12(2)7-8(12)14-10-15-9(13)16-11(17-10)18-3-5-19-6-4-18/h8H,3-7H2,1-2H3,(H,14,15,16,17)
InChIKeyHZFJTLZDAWUTGP-UHFFFAOYSA-N
XLogP1.57
TPSA63.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.76
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-chloro-6-morpholin-4-yl-1,3,5-triazin-2-yl)-1,1-dimethylhydrazine
CID 83020025
4-chloro-6-morpholin-4-yl-N-propan-2-yl-1,3,5-triazin-2-amine
CID 759895
4-chloro-N-(2-methoxyethyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 62868206
4-chloro-N-(3-methylpentan-2-yl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 62863402
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
1-[(4-chloro-6-morpholin-4-yl-1,3,5-triazin-2-yl)amino]propan-2-ol
CID 55125040
4-chloro-6-morpholin-4-yl-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazin-2-amine
CID 139072586
2-N-(2,2-dimethylcyclopropyl)-4-N-ethyl-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine
CID 80816973
4-chloro-N-[(5-methylfuran-2-yl)methyl]-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 62864878
4-chloro-N-(5-methylhexan-2-yl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 63925326
4-[4-(azepan-1-yl)-6-morpholin-4-yl-1,3,5-triazin-2-yl]morpholine;4-(4-chloro-6-morpholin-4-yl-1,3,5-triazin-2-yl)morpholine
CID 45133473

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(2,2-dimethylcyclopropyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The IUPAC name of 4-chloro-N-(2,2-dimethylcyclopropyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine (CID 55124915) is 4-chloro-N-(2,2-dimethylcyclopropyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-chloro-N-(2,2-dimethylcyclopropyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-chloro-N-(2,2-dimethylcyclopropyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine is CC1(C)CC1Nc1nc(Cl)nc(N2CCOCC2)n1.
What is the InChIKey of 4-chloro-N-(2,2-dimethylcyclopropyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The InChIKey is HZFJTLZDAWUTGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18ClN5O/c1-12(2)7-8(12)14-10-15-9(13)16-11(17-10)18-3-5-19-6-4-18/h8H,3-7H2,1-2H3,(H,14,15,16,17).
What are the key properties of 4-chloro-N-(2,2-dimethylcyclopropyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine?
4-chloro-N-(2,2-dimethylcyclopropyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine has a molecular weight of 283.76 g/mol, XLogP of 1.57, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(2,2-dimethylcyclopropyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 55124915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).