N-[[2-[(dimethylamino)methyl]phenyl]methyl]-2-methyl-5-propylpyrimidin-4-amine

C18H26N4 — CID 134709086

IUPACN-[[2-[(dimethylamino)methyl]phenyl]methyl]-2-methyl-5-propylpyrimidin-4-amine
SMILESCCCc1cnc(C)nc1NCc1ccccc1CN(C)C
InChIInChI=1S/C18H26N4/c1-5-8-16-12-19-14(2)21-18(16)20-11-15-9-6-7-10-17(15)13-22(3)4/h6-7,9-10,12H,5,8,11,13H2,1-4H3,(H,19,20,21)
InChIKeyMEUIGEBRJKFQSM-UHFFFAOYSA-N
MW298.43 g/mol
LogP3.41
Rot. Bonds7

About N-[[2-[(dimethylamino)methyl]phenyl]methyl]-2-methyl-5-propylpyrimidin-4-amine

N-[[2-[(dimethylamino)methyl]phenyl]methyl]-2-methyl-5-propylpyrimidin-4-amine (PubChem CID 134709086) has the molecular formula C18H26N4 and a molecular weight of 298.43 g/mol. Its IUPAC name is N-[[2-[(dimethylamino)methyl]phenyl]methyl]-2-methyl-5-propylpyrimidin-4-amine.

Molecular Properties

Compound NameN-[[2-[(dimethylamino)methyl]phenyl]methyl]-2-methyl-5-propylpyrimidin-4-amine
PubChem CID134709086
Molecular FormulaC18H26N4
Molecular Weight298.43 g/mol
Exact Mass298.22
IUPAC NameN-[[2-[(dimethylamino)methyl]phenyl]methyl]-2-methyl-5-propylpyrimidin-4-amine
SMILESCCCc1cnc(C)nc1NCc1ccccc1CN(C)C
InChIInChI=1S/C18H26N4/c1-5-8-16-12-19-14(2)21-18(16)20-11-15-9-6-7-10-17(15)13-22(3)4/h6-7,9-10,12H,5,8,11,13H2,1-4H3,(H,19,20,21)
InChIKeyMEUIGEBRJKFQSM-UHFFFAOYSA-N
XLogP3.41
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.43
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-N-[[2-(2-methylimidazol-1-yl)phenyl]methyl]-5-propylpyrimidin-4-amine
CID 135115289
2-methyl-5-propyl-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)pyrimidin-4-amine
CID 56917474
N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-methyl-5-propylpyrimidin-4-amine
CID 134706887
N,N-dimethyl-1-(2-propylphenyl)methanamine
CID 12709346
N-[(4-ethyl-2-methyl-1,3-thiazol-5-yl)methyl]-2-methyl-5-propylpyrimidin-4-amine
CID 135116875
1-[2-[(dimethylamino)methyl]phenyl]-N-[(2-methyl-1H-imidazol-5-yl)methyl]methanamine
CID 62743984
N-methyl-2-[(2-methyl-5-propylpyrimidin-4-yl)amino]ethanesulfonamide
CID 50970084
2-[2-[(2-methyl-5-propylpyrimidin-4-yl)amino]ethyl]-3H-quinazolin-4-one
CID 137314025
N-butyl-2-methyl-5-(2-thiophen-2-ylethyl)pyrimidin-4-amine
CID 118332675
5-(aminomethyl)-N-ethyl-2-methylpyrimidin-4-amine
CID 126972399
2-methyl-N-(oxan-3-ylmethyl)-5-propylpyrimidin-4-amine
CID 134698138
[1-[[(2-methyl-5-propylpyrimidin-4-yl)amino]methyl]cyclobutyl]methanol
CID 131905026

Frequently Asked Questions

What is the IUPAC name of N-[[2-[(dimethylamino)methyl]phenyl]methyl]-2-methyl-5-propylpyrimidin-4-amine?
The IUPAC name of N-[[2-[(dimethylamino)methyl]phenyl]methyl]-2-methyl-5-propylpyrimidin-4-amine (CID 134709086) is N-[[2-[(dimethylamino)methyl]phenyl]methyl]-2-methyl-5-propylpyrimidin-4-amine.
What is the SMILES notation for N-[[2-[(dimethylamino)methyl]phenyl]methyl]-2-methyl-5-propylpyrimidin-4-amine?
The canonical SMILES for N-[[2-[(dimethylamino)methyl]phenyl]methyl]-2-methyl-5-propylpyrimidin-4-amine is CCCc1cnc(C)nc1NCc1ccccc1CN(C)C.
What is the InChIKey of N-[[2-[(dimethylamino)methyl]phenyl]methyl]-2-methyl-5-propylpyrimidin-4-amine?
The InChIKey is MEUIGEBRJKFQSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4/c1-5-8-16-12-19-14(2)21-18(16)20-11-15-9-6-7-10-17(15)13-22(3)4/h6-7,9-10,12H,5,8,11,13H2,1-4H3,(H,19,20,21).
What are the key properties of N-[[2-[(dimethylamino)methyl]phenyl]methyl]-2-methyl-5-propylpyrimidin-4-amine?
N-[[2-[(dimethylamino)methyl]phenyl]methyl]-2-methyl-5-propylpyrimidin-4-amine has a molecular weight of 298.43 g/mol, XLogP of 3.41, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-[(dimethylamino)methyl]phenyl]methyl]-2-methyl-5-propylpyrimidin-4-amine is sourced from PubChem (CID 134709086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).