6-chloro-2-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,3,5-triazine-2,4-diamine

C10H17ClN6 — CID 105420861

IUPAC6-chloro-2-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,3,5-triazine-2,4-diamine
SMILESCN(C)C1(CNc2nc(N)nc(Cl)n2)CCC1
InChIInChI=1S/C10H17ClN6/c1-17(2)10(4-3-5-10)6-13-9-15-7(11)14-8(12)16-9/h3-6H2,1-2H3,(H3,12,13,14,15,16)
InChIKeyYWYDEEFYUNCSPS-UHFFFAOYSA-N
MW256.74 g/mol
LogP1.00
Rot. Bonds4

About 6-chloro-2-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,3,5-triazine-2,4-diamine

6-chloro-2-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,3,5-triazine-2,4-diamine (PubChem CID 105420861) has the molecular formula C10H17ClN6 and a molecular weight of 256.74 g/mol. Its IUPAC name is 6-chloro-2-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-chloro-2-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,3,5-triazine-2,4-diamine
PubChem CID105420861
Molecular FormulaC10H17ClN6
Molecular Weight256.74 g/mol
Exact Mass256.12
IUPAC Name6-chloro-2-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,3,5-triazine-2,4-diamine
SMILESCN(C)C1(CNc2nc(N)nc(Cl)n2)CCC1
InChIInChI=1S/C10H17ClN6/c1-17(2)10(4-3-5-10)6-13-9-15-7(11)14-8(12)16-9/h3-6H2,1-2H3,(H3,12,13,14,15,16)
InChIKeyYWYDEEFYUNCSPS-UHFFFAOYSA-N
XLogP1.00
TPSA79.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.74
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-chloro-N-[[1-(dimethylamino)cyclopentyl]methyl]-6-methoxy-1,3,5-triazin-2-amine
CID 83113996
1-[[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]methyl]cyclopentan-1-ol
CID 80843196
2-N-[[1-(dimethylamino)cyclopentyl]methyl]-6-ethoxy-1,3,5-triazine-2,4-diamine
CID 83117873
4-chloro-N-[[1-(dimethylamino)cyclobutyl]methyl]-6-(1,2,4-triazol-1-yl)-1,3,5-triazin-2-amine
CID 105419837
4-chloro-N-[[1-(dimethylamino)cyclobutyl]methyl]-6-imidazol-1-yl-1,3,5-triazin-2-amine
CID 105419825
6-chloro-2-N-prop-2-ynyl-1,3,5-triazine-2,4-diamine
CID 118444193
6-chloro-2-N-[[1-(dimethylamino)cyclopentyl]methyl]pyridine-2,4-diamine
CID 104923863
4-N-[[1-(dimethylamino)cyclobutyl]methyl]-6-methoxypyrimidine-2,4-diamine
CID 114053245
2,6-dichloro-1-N-[[1-(dimethylamino)cyclobutyl]methyl]benzene-1,4-diamine
CID 106890863
3,5-dichloro-6-N-[[1-(dimethylamino)cyclopentyl]methyl]pyridine-2,6-diamine
CID 102759502
N-[[1-(dimethylamino)cyclobutyl]methyl]-4-(trifluoromethyl)pyrimidin-2-amine
CID 105418954
2-chloro-N-[[1-(dimethylamino)cyclopentyl]methyl]pyrimidin-4-amine
CID 80703179

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-chloro-2-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,3,5-triazine-2,4-diamine (CID 105420861) is 6-chloro-2-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-chloro-2-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-chloro-2-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,3,5-triazine-2,4-diamine is CN(C)C1(CNc2nc(N)nc(Cl)n2)CCC1.
What is the InChIKey of 6-chloro-2-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,3,5-triazine-2,4-diamine?
The InChIKey is YWYDEEFYUNCSPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17ClN6/c1-17(2)10(4-3-5-10)6-13-9-15-7(11)14-8(12)16-9/h3-6H2,1-2H3,(H3,12,13,14,15,16).
What are the key properties of 6-chloro-2-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,3,5-triazine-2,4-diamine?
6-chloro-2-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,3,5-triazine-2,4-diamine has a molecular weight of 256.74 g/mol, XLogP of 1.00, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-N-[[1-(dimethylamino)cyclobutyl]methyl]-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 105420861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).