4-methyl-N-propan-2-yl-1,3,5-triazin-2-amine

C7H12N4 — CID 22444768

IUPAC4-methyl-N-propan-2-yl-1,3,5-triazin-2-amine
SMILESCc1ncnc(NC(C)C)n1
InChIInChI=1S/C7H12N4/c1-5(2)10-7-9-4-8-6(3)11-7/h4-5H,1-3H3,(H,8,9,10,11)
InChIKeyKFXPVUBQWZMGFP-UHFFFAOYSA-N
MW152.20 g/mol
LogP1.00
Rot. Bonds2

About 4-methyl-N-propan-2-yl-1,3,5-triazin-2-amine

4-methyl-N-propan-2-yl-1,3,5-triazin-2-amine (PubChem CID 22444768) has the molecular formula C7H12N4 and a molecular weight of 152.20 g/mol. Its IUPAC name is 4-methyl-N-propan-2-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-methyl-N-propan-2-yl-1,3,5-triazin-2-amine
PubChem CID22444768
Molecular FormulaC7H12N4
Molecular Weight152.20 g/mol
Exact Mass152.11
IUPAC Name4-methyl-N-propan-2-yl-1,3,5-triazin-2-amine
SMILESCc1ncnc(NC(C)C)n1
InChIInChI=1S/C7H12N4/c1-5(2)10-7-9-4-8-6(3)11-7/h4-5H,1-3H3,(H,8,9,10,11)
InChIKeyKFXPVUBQWZMGFP-UHFFFAOYSA-N
XLogP1.00
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N~2~,N~4~-Diethyl-6-methyl-1,3,5-triazine-2,4-diamine
CID 16086
4,6-Bis-isopropylamino-[1,3,5]triazine-2-carbonitrile
CID 644401
2-Amino-6-(isopropylamino)1,3,5-triazine
CID 186839
s-Triazine, 2-(ethylamino)-4-(isopropylamino)-
CID 6451759
s-Triazine, 4,6-bis(isopropylamino)-2-ethyl-
CID 33405
1,3,5-Triazin-2-amine, 4-chloro-6-ethyl-N-(1-methylethyl)-
CID 3044737
4-Methyl-1,3,5-triazin-2-amine
CID 33971
4-chloro-N-cyclopropyl-6-methyl-1,3,5-triazin-2-amine
CID 18965208
1,3,5-Triazine-2,4-diamine, N,N'-bis(1-methylethyl)-
CID 77795
s-Triazine, 2,4-bis(isopropylamino)-6-propyl-
CID 33411
s-Triazine, 2-amino-4-isopropylamino-6-trifluoromethyl-
CID 3041987
1,3,5-Triazin-2-amine, N-(1-methylethyl)-
CID 35101

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-propan-2-yl-1,3,5-triazin-2-amine?
The IUPAC name of 4-methyl-N-propan-2-yl-1,3,5-triazin-2-amine (CID 22444768) is 4-methyl-N-propan-2-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-methyl-N-propan-2-yl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-methyl-N-propan-2-yl-1,3,5-triazin-2-amine is Cc1ncnc(NC(C)C)n1.
What is the InChIKey of 4-methyl-N-propan-2-yl-1,3,5-triazin-2-amine?
The InChIKey is KFXPVUBQWZMGFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N4/c1-5(2)10-7-9-4-8-6(3)11-7/h4-5H,1-3H3,(H,8,9,10,11).
What are the key properties of 4-methyl-N-propan-2-yl-1,3,5-triazin-2-amine?
4-methyl-N-propan-2-yl-1,3,5-triazin-2-amine has a molecular weight of 152.20 g/mol, XLogP of 1.00, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-propan-2-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 22444768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).