6-[amino(cyclopropyl)methyl]-1,3,5-triazine-2,4-diamine

C7H12N6 — CID 130568176

IUPAC6-[amino(cyclopropyl)methyl]-1,3,5-triazine-2,4-diamine
SMILESNc1nc(N)nc(C(N)C2CC2)n1
InChIInChI=1S/C7H12N6/c8-4(3-1-2-3)5-11-6(9)13-7(10)12-5/h3-4H,1-2,8H2,(H4,9,10,11,12,13)
InChIKeyYBCPYUNZQUWARZ-UHFFFAOYSA-N
MW180.22 g/mol
LogP-0.55
Rot. Bonds2

About 6-[amino(cyclopropyl)methyl]-1,3,5-triazine-2,4-diamine

6-[amino(cyclopropyl)methyl]-1,3,5-triazine-2,4-diamine (PubChem CID 130568176) has the molecular formula C7H12N6 and a molecular weight of 180.22 g/mol. Its IUPAC name is 6-[amino(cyclopropyl)methyl]-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-[amino(cyclopropyl)methyl]-1,3,5-triazine-2,4-diamine
PubChem CID130568176
Molecular FormulaC7H12N6
Molecular Weight180.22 g/mol
Exact Mass180.11
IUPAC Name6-[amino(cyclopropyl)methyl]-1,3,5-triazine-2,4-diamine
SMILESNc1nc(N)nc(C(N)C2CC2)n1
InChIInChI=1S/C7H12N6/c8-4(3-1-2-3)5-11-6(9)13-7(10)12-5/h3-4H,1-2,8H2,(H4,9,10,11,12,13)
InChIKeyYBCPYUNZQUWARZ-UHFFFAOYSA-N
XLogP-0.55
TPSA116.73 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.22
LogP ≤ 5-0.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 6-[amino(cyclopropyl)methyl]-1,3,5-triazine-2,4-diamine 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

5-[amino(cyclopropyl)methyl]-2-methyl-1,2,4-triazol-3-amine
CID 104605550
5-[amino(cyclopropyl)methyl]-1,2,4-oxadiazol-3-amine
CID 65416408
cyclopropyl-(4-ethyl-6-propan-2-ylpyrimidin-2-yl)methanamine
CID 63318736
1,3,5-triazine-2,4,6-triamine
CID 67592325
1,3,5-triazine-2,4,6-triamine
CID 67883493
1,3,5-triazine-2,4,6-triamine
CID 22011128
6-(difluoromethyl)-1,3,5-triazine-2,4-diamine
CID 44725305
(5-cycloheptyl-1,2,4-oxadiazol-3-yl)-cyclopropylmethanamine
CID 62589285
cyclopropyl-[5-(2,2-dimethylcyclopropyl)-1,2,4-oxadiazol-3-yl]methanamine
CID 107002954
(R)-cyclopropyl-(3,6-difluoro-2-pyridinyl)methanamine
CID 130617510
cerium;1,3,5-triazine-2,4,6-triamine
CID 161330303
[5-(2-bromophenyl)-1,2,4-oxadiazol-3-yl]-cyclopropylmethanamine
CID 61325661

Frequently Asked Questions

What is the IUPAC name of 6-[amino(cyclopropyl)methyl]-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-[amino(cyclopropyl)methyl]-1,3,5-triazine-2,4-diamine (CID 130568176) is 6-[amino(cyclopropyl)methyl]-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-[amino(cyclopropyl)methyl]-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-[amino(cyclopropyl)methyl]-1,3,5-triazine-2,4-diamine is Nc1nc(N)nc(C(N)C2CC2)n1.
What is the InChIKey of 6-[amino(cyclopropyl)methyl]-1,3,5-triazine-2,4-diamine?
The InChIKey is YBCPYUNZQUWARZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N6/c8-4(3-1-2-3)5-11-6(9)13-7(10)12-5/h3-4H,1-2,8H2,(H4,9,10,11,12,13).
What are the key properties of 6-[amino(cyclopropyl)methyl]-1,3,5-triazine-2,4-diamine?
6-[amino(cyclopropyl)methyl]-1,3,5-triazine-2,4-diamine has a molecular weight of 180.22 g/mol, XLogP of -0.55, 2 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[amino(cyclopropyl)methyl]-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 130568176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).