4-(dimethylamino)-2-ethylpyrimidine-5-carboximidamide

C9H15N5 — CID 83878494

IUPAC4-(dimethylamino)-2-ethylpyrimidine-5-carboximidamide
SMILES[H]/N=C(\N)c1cnc(CC)nc1N(C)C
InChIInChI=1S/C9H15N5/c1-4-7-12-5-6(8(10)11)9(13-7)14(2)3/h5H,4H2,1-3H3,(H3,10,11)
InChIKeyLNFKAMUJLIVQJX-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.39
Rot. Bonds3

About 4-(dimethylamino)-2-ethylpyrimidine-5-carboximidamide

4-(dimethylamino)-2-ethylpyrimidine-5-carboximidamide (PubChem CID 83878494) has the molecular formula C9H15N5 and a molecular weight of 193.25 g/mol. Its IUPAC name is 4-(dimethylamino)-2-ethylpyrimidine-5-carboximidamide.

Molecular Properties

Compound Name4-(dimethylamino)-2-ethylpyrimidine-5-carboximidamide
PubChem CID83878494
Molecular FormulaC9H15N5
Molecular Weight193.25 g/mol
Exact Mass193.13
IUPAC Name4-(dimethylamino)-2-ethylpyrimidine-5-carboximidamide
SMILES[H]/N=C(\N)c1cnc(CC)nc1N(C)C
InChIInChI=1S/C9H15N5/c1-4-7-12-5-6(8(10)11)9(13-7)14(2)3/h5H,4H2,1-3H3,(H3,10,11)
InChIKeyLNFKAMUJLIVQJX-UHFFFAOYSA-N
XLogP0.39
TPSA78.89 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-ethyl-4-propan-2-yloxypyrimidine-5-carboximidamide
CID 83883979
3-[methyl(propan-2-yl)amino]pyridazine-4-carboximidamide
CID 80512957
3-[methyl(4-methylpentan-2-yl)amino]pyridazine-4-carboximidamide
CID 80513543
3-[2-ethoxyethyl(methyl)amino]pyridazine-4-carboximidamide
CID 81056507
4-(dimethylamino)-2-methylpyrimidine-5-carboxamide
CID 23423588
3-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]pyridazine-4-carboximidamide
CID 80513561
4-[butan-2-yl(methyl)amino]quinoline-3-carboximidamide
CID 43669816
4-[propyl(2,2,2-trifluoroethyl)amino]pyrimidine-5-carboximidamide
CID 112755775
3-chloro-2-(4-ethyl-N-methylanilino)pyridine-4-carboximidamide
CID 107060226
3-[cyclopentylmethyl(methyl)amino]pyridazine-4-carboximidamide
CID 80513486
2-[(dimethylamino)methyl]-1,3-thiazole-5-carboximidamide
CID 82424599
3-[cyclopentyl(methyl)amino]pyridazine-4-carboximidamide
CID 80513212

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-2-ethylpyrimidine-5-carboximidamide?
The IUPAC name of 4-(dimethylamino)-2-ethylpyrimidine-5-carboximidamide (CID 83878494) is 4-(dimethylamino)-2-ethylpyrimidine-5-carboximidamide.
What is the SMILES notation for 4-(dimethylamino)-2-ethylpyrimidine-5-carboximidamide?
The canonical SMILES for 4-(dimethylamino)-2-ethylpyrimidine-5-carboximidamide is [H]/N=C(\N)c1cnc(CC)nc1N(C)C.
What is the InChIKey of 4-(dimethylamino)-2-ethylpyrimidine-5-carboximidamide?
The InChIKey is LNFKAMUJLIVQJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N5/c1-4-7-12-5-6(8(10)11)9(13-7)14(2)3/h5H,4H2,1-3H3,(H3,10,11).
What are the key properties of 4-(dimethylamino)-2-ethylpyrimidine-5-carboximidamide?
4-(dimethylamino)-2-ethylpyrimidine-5-carboximidamide has a molecular weight of 193.25 g/mol, XLogP of 0.39, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-2-ethylpyrimidine-5-carboximidamide is sourced from PubChem (CID 83878494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).