2-amino-4-(2-ethoxyphenyl)-N,N-diethyl-6-methylpyrimidine-5-carboxamide

C18H24N4O2 — CID 54853820

IUPAC2-amino-4-(2-ethoxyphenyl)-N,N-diethyl-6-methylpyrimidine-5-carboxamide
SMILESCCOc1ccccc1-c1nc(N)nc(C)c1C(=O)N(CC)CC
InChIInChI=1S/C18H24N4O2/c1-5-22(6-2)17(23)15-12(4)20-18(19)21-16(15)13-10-8-9-11-14(13)24-7-3/h8-11H,5-7H2,1-4H3,(H2,19,20,21)
InChIKeyLWYURILVKMDTFG-UHFFFAOYSA-N
MW328.42 g/mol
LogP2.91
Rot. Bonds6

About 2-amino-4-(2-ethoxyphenyl)-N,N-diethyl-6-methylpyrimidine-5-carboxamide

2-amino-4-(2-ethoxyphenyl)-N,N-diethyl-6-methylpyrimidine-5-carboxamide (PubChem CID 54853820) has the molecular formula C18H24N4O2 and a molecular weight of 328.42 g/mol. Its IUPAC name is 2-amino-4-(2-ethoxyphenyl)-N,N-diethyl-6-methylpyrimidine-5-carboxamide.

Molecular Properties

Compound Name2-amino-4-(2-ethoxyphenyl)-N,N-diethyl-6-methylpyrimidine-5-carboxamide
PubChem CID54853820
Molecular FormulaC18H24N4O2
Molecular Weight328.42 g/mol
Exact Mass328.19
IUPAC Name2-amino-4-(2-ethoxyphenyl)-N,N-diethyl-6-methylpyrimidine-5-carboxamide
SMILESCCOc1ccccc1-c1nc(N)nc(C)c1C(=O)N(CC)CC
InChIInChI=1S/C18H24N4O2/c1-5-22(6-2)17(23)15-12(4)20-18(19)21-16(15)13-10-8-9-11-14(13)24-7-3/h8-11H,5-7H2,1-4H3,(H2,19,20,21)
InChIKeyLWYURILVKMDTFG-UHFFFAOYSA-N
XLogP2.91
TPSA81.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.42
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-amino-4-(2-ethoxyphenyl)-N,N-diethyl-6-methylpyrimidine-5-carboxamide 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

2-amino-N,N-diethyl-4-methyl-6-[2-(3-methylbutoxy)phenyl]pyrimidine-5-carboxamide
CID 54854046
ethyl 2-amino-4-(2-ethoxyphenyl)-6-methylpyrimidine-5-carboxylate
CID 54851455
2-amino-N,N,4-trimethyl-6-(2-propoxyphenyl)pyrimidine-5-carboxamide
CID 54851987
2-amino-4-(2-hexoxyphenyl)-N,N,6-trimethylpyrimidine-5-carboxamide
CID 54851875
2-amino-4-methyl-6-(2-propoxyphenyl)pyrimidine-5-carboxylic acid
CID 54851462
ethyl 2-amino-4-methyl-6-[2-(2-methylpropoxy)phenyl]pyrimidine-5-carboxylate
CID 54851288
2-amino-N-ethyl-4-methyl-6-[2-(3-methylbutoxy)phenyl]pyrimidine-5-carboxamide
CID 54853960
2-amino-4-(4-tert-butylphenyl)-N,N-diethyl-6-methylpyrimidine-5-carboxamide
CID 54853967
4-(2-ethoxyphenyl)-2,6-bis(2-methylphenyl)pyrimidine-5-carboxylic acid
CID 151058950
2-amino-4-(3-butoxyphenyl)-N,N-diethyl-6-methylpyrimidine-5-carboxamide
CID 54853822
2-amino-N,4-dimethyl-6-[2-(3-methylbutoxy)phenyl]pyrimidine-5-carboxamide
CID 54853653
2-amino-N,N-diethyl-4-methyl-6-(2-phenylethyl)pyrimidine-5-carboxamide
CID 54853965

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-(2-ethoxyphenyl)-N,N-diethyl-6-methylpyrimidine-5-carboxamide?
The IUPAC name of 2-amino-4-(2-ethoxyphenyl)-N,N-diethyl-6-methylpyrimidine-5-carboxamide (CID 54853820) is 2-amino-4-(2-ethoxyphenyl)-N,N-diethyl-6-methylpyrimidine-5-carboxamide.
What is the SMILES notation for 2-amino-4-(2-ethoxyphenyl)-N,N-diethyl-6-methylpyrimidine-5-carboxamide?
The canonical SMILES for 2-amino-4-(2-ethoxyphenyl)-N,N-diethyl-6-methylpyrimidine-5-carboxamide is CCOc1ccccc1-c1nc(N)nc(C)c1C(=O)N(CC)CC.
What is the InChIKey of 2-amino-4-(2-ethoxyphenyl)-N,N-diethyl-6-methylpyrimidine-5-carboxamide?
The InChIKey is LWYURILVKMDTFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O2/c1-5-22(6-2)17(23)15-12(4)20-18(19)21-16(15)13-10-8-9-11-14(13)24-7-3/h8-11H,5-7H2,1-4H3,(H2,19,20,21).
What are the key properties of 2-amino-4-(2-ethoxyphenyl)-N,N-diethyl-6-methylpyrimidine-5-carboxamide?
2-amino-4-(2-ethoxyphenyl)-N,N-diethyl-6-methylpyrimidine-5-carboxamide has a molecular weight of 328.42 g/mol, XLogP of 2.91, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-(2-ethoxyphenyl)-N,N-diethyl-6-methylpyrimidine-5-carboxamide is sourced from PubChem (CID 54853820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).