2-[4-[(dimethylamino)methyl]phenyl]-N-ethylpyrimidin-4-amine

C15H20N4 — CID 74234866

IUPAC2-[4-[(dimethylamino)methyl]phenyl]-N-ethylpyrimidin-4-amine
SMILESCCNc1ccnc(-c2ccc(CN(C)C)cc2)n1
InChIInChI=1S/C15H20N4/c1-4-16-14-9-10-17-15(18-14)13-7-5-12(6-8-13)11-19(2)3/h5-10H,4,11H2,1-3H3,(H,16,17,18)
InChIKeyKAILSYYQWGNMEK-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.64
Rot. Bonds5

About 2-[4-[(dimethylamino)methyl]phenyl]-N-ethylpyrimidin-4-amine

2-[4-[(dimethylamino)methyl]phenyl]-N-ethylpyrimidin-4-amine (PubChem CID 74234866) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is 2-[4-[(dimethylamino)methyl]phenyl]-N-ethylpyrimidin-4-amine.

Molecular Properties

Compound Name2-[4-[(dimethylamino)methyl]phenyl]-N-ethylpyrimidin-4-amine
PubChem CID74234866
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC Name2-[4-[(dimethylamino)methyl]phenyl]-N-ethylpyrimidin-4-amine
SMILESCCNc1ccnc(-c2ccc(CN(C)C)cc2)n1
InChIInChI=1S/C15H20N4/c1-4-16-14-9-10-17-15(18-14)13-7-5-12(6-8-13)11-19(2)3/h5-10H,4,11H2,1-3H3,(H,16,17,18)
InChIKeyKAILSYYQWGNMEK-UHFFFAOYSA-N
XLogP2.64
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-cyclopropylphenyl)-N-ethylpyrimidin-4-amine
CID 79980530
2-(3,5-dichlorophenyl)-N-ethylpyrimidin-4-amine
CID 62201542
2-(3-bromo-4-fluorophenyl)-N-ethylpyrimidin-4-amine
CID 82801474
4-[4-(ethylamino)pyrimidin-2-yl]-2-fluorophenol
CID 136813753
N-[(3,4-dichlorophenyl)methyl]-2-[4-(dimethylamino)phenyl]pyrimidin-4-amine
CID 44820582
2-(3-chloro-4-methoxyphenyl)-N-ethylpyrimidin-4-amine
CID 65022574
2-(4-methoxyphenyl)-N-[2-(4-methoxyphenyl)ethyl]pyrimidin-4-amine
CID 117084765
2-(3-chloro-5-fluorophenyl)-N-ethylpyrimidin-4-amine
CID 114454535
2-(4-methoxyphenyl)-N-propylpyrimidin-4-amine
CID 62191848
2-(2-bromophenyl)-N-ethylpyrimidin-4-amine
CID 62190265
N-[(3R)-1-[4-[4-(ethylamino)pyrimidin-2-yl]benzoyl]pyrrolidin-3-yl]acetamide
CID 126429780
N-ethyl-2-(4-methyl-1,3-thiazol-2-yl)pyrimidin-4-amine
CID 104771355

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(dimethylamino)methyl]phenyl]-N-ethylpyrimidin-4-amine?
The IUPAC name of 2-[4-[(dimethylamino)methyl]phenyl]-N-ethylpyrimidin-4-amine (CID 74234866) is 2-[4-[(dimethylamino)methyl]phenyl]-N-ethylpyrimidin-4-amine.
What is the SMILES notation for 2-[4-[(dimethylamino)methyl]phenyl]-N-ethylpyrimidin-4-amine?
The canonical SMILES for 2-[4-[(dimethylamino)methyl]phenyl]-N-ethylpyrimidin-4-amine is CCNc1ccnc(-c2ccc(CN(C)C)cc2)n1.
What is the InChIKey of 2-[4-[(dimethylamino)methyl]phenyl]-N-ethylpyrimidin-4-amine?
The InChIKey is KAILSYYQWGNMEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-4-16-14-9-10-17-15(18-14)13-7-5-12(6-8-13)11-19(2)3/h5-10H,4,11H2,1-3H3,(H,16,17,18).
What are the key properties of 2-[4-[(dimethylamino)methyl]phenyl]-N-ethylpyrimidin-4-amine?
2-[4-[(dimethylamino)methyl]phenyl]-N-ethylpyrimidin-4-amine has a molecular weight of 256.35 g/mol, XLogP of 2.64, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(dimethylamino)methyl]phenyl]-N-ethylpyrimidin-4-amine is sourced from PubChem (CID 74234866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).