2-[2-(dimethylamino)ethyl-methylamino]-6-methylpyrimidine-4-carboximidamide

C11H20N6 — CID 107550514

IUPAC2-[2-(dimethylamino)ethyl-methylamino]-6-methylpyrimidine-4-carboximidamide
SMILES[H]/N=C(\N)c1cc(C)nc(N(C)CCN(C)C)n1
InChIInChI=1S/C11H20N6/c1-8-7-9(10(12)13)15-11(14-8)17(4)6-5-16(2)3/h7H,5-6H2,1-4H3,(H3,12,13)
InChIKeyZHXXIXBONDQFSG-UHFFFAOYSA-N
MW236.32 g/mol
LogP0.07
Rot. Bonds5

About 2-[2-(dimethylamino)ethyl-methylamino]-6-methylpyrimidine-4-carboximidamide

2-[2-(dimethylamino)ethyl-methylamino]-6-methylpyrimidine-4-carboximidamide (PubChem CID 107550514) has the molecular formula C11H20N6 and a molecular weight of 236.32 g/mol. Its IUPAC name is 2-[2-(dimethylamino)ethyl-methylamino]-6-methylpyrimidine-4-carboximidamide.

Molecular Properties

Compound Name2-[2-(dimethylamino)ethyl-methylamino]-6-methylpyrimidine-4-carboximidamide
PubChem CID107550514
Molecular FormulaC11H20N6
Molecular Weight236.32 g/mol
Exact Mass236.17
IUPAC Name2-[2-(dimethylamino)ethyl-methylamino]-6-methylpyrimidine-4-carboximidamide
SMILES[H]/N=C(\N)c1cc(C)nc(N(C)CCN(C)C)n1
InChIInChI=1S/C11H20N6/c1-8-7-9(10(12)13)15-11(14-8)17(4)6-5-16(2)3/h7H,5-6H2,1-4H3,(H3,12,13)
InChIKeyZHXXIXBONDQFSG-UHFFFAOYSA-N
XLogP0.07
TPSA82.13 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

2-[3-hydroxybutyl(methyl)amino]-6-methylpyrimidine-4-carboximidamide
CID 107550677
6-methyl-2-[methyl(2-propan-2-yloxyethyl)amino]pyrimidine-4-carboximidamide
CID 107550627
2-(dibutylamino)-6-methylpyrimidine-4-carboximidamide
CID 107550121
2-[bis(2-methylpropyl)amino]-6-methylpyrimidine-4-carboximidamide
CID 107550214
2-[cyclopropyl(methyl)amino]-6-methylpyrimidine-4-carboximidamide
CID 107550128
6-methyl-2-[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]pyrimidine-4-carboximidamide
CID 107550498
2-[bis(cyclopropylmethyl)amino]-6-methylpyrimidine-4-carboximidamide
CID 107550536
2-(N-ethyl-2-methylanilino)-6-methylpyrimidine-4-carboximidamide
CID 107550077
2-[cyclopropyl(propyl)amino]-6-methylpyrimidine-4-carboximidamide
CID 107550138
6-methyl-2-[methyl-(1-methylpiperidin-4-yl)amino]pyrimidine-4-carboximidamide
CID 107550091
2-[cyclopentyl(3-methylbutyl)amino]-6-methylpyrimidine-4-carboximidamide
CID 107550614
2-[1-(2-chlorophenyl)ethyl-methylamino]-6-methylpyrimidine-4-carboximidamide
CID 107550456

Frequently Asked Questions

What is the IUPAC name of 2-[2-(dimethylamino)ethyl-methylamino]-6-methylpyrimidine-4-carboximidamide?
The IUPAC name of 2-[2-(dimethylamino)ethyl-methylamino]-6-methylpyrimidine-4-carboximidamide (CID 107550514) is 2-[2-(dimethylamino)ethyl-methylamino]-6-methylpyrimidine-4-carboximidamide.
What is the SMILES notation for 2-[2-(dimethylamino)ethyl-methylamino]-6-methylpyrimidine-4-carboximidamide?
The canonical SMILES for 2-[2-(dimethylamino)ethyl-methylamino]-6-methylpyrimidine-4-carboximidamide is [H]/N=C(\N)c1cc(C)nc(N(C)CCN(C)C)n1.
What is the InChIKey of 2-[2-(dimethylamino)ethyl-methylamino]-6-methylpyrimidine-4-carboximidamide?
The InChIKey is ZHXXIXBONDQFSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N6/c1-8-7-9(10(12)13)15-11(14-8)17(4)6-5-16(2)3/h7H,5-6H2,1-4H3,(H3,12,13).
What are the key properties of 2-[2-(dimethylamino)ethyl-methylamino]-6-methylpyrimidine-4-carboximidamide?
2-[2-(dimethylamino)ethyl-methylamino]-6-methylpyrimidine-4-carboximidamide has a molecular weight of 236.32 g/mol, XLogP of 0.07, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(dimethylamino)ethyl-methylamino]-6-methylpyrimidine-4-carboximidamide is sourced from PubChem (CID 107550514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).