N-benzyl-N,6-dimethyl-2-phenylpyrimidin-4-amine

C19H19N3 — CID 746584

IUPACN-benzyl-N,6-dimethyl-2-phenylpyrimidin-4-amine
SMILESCc1cc(N(C)Cc2ccccc2)nc(-c2ccccc2)n1
InChIInChI=1S/C19H19N3/c1-15-13-18(22(2)14-16-9-5-3-6-10-16)21-19(20-15)17-11-7-4-8-12-17/h3-13H,14H2,1-2H3
InChIKeyKVQUKSFPPRUDAF-UHFFFAOYSA-N
MW289.38 g/mol
LogP4.09
Rot. Bonds4

About N-benzyl-N,6-dimethyl-2-phenylpyrimidin-4-amine

N-benzyl-N,6-dimethyl-2-phenylpyrimidin-4-amine (PubChem CID 746584) has the molecular formula C19H19N3 and a molecular weight of 289.38 g/mol. Its IUPAC name is N-benzyl-N,6-dimethyl-2-phenylpyrimidin-4-amine.

Molecular Properties

Compound NameN-benzyl-N,6-dimethyl-2-phenylpyrimidin-4-amine
PubChem CID746584
Molecular FormulaC19H19N3
Molecular Weight289.38 g/mol
Exact Mass289.16
IUPAC NameN-benzyl-N,6-dimethyl-2-phenylpyrimidin-4-amine
SMILESCc1cc(N(C)Cc2ccccc2)nc(-c2ccccc2)n1
InChIInChI=1S/C19H19N3/c1-15-13-18(22(2)14-16-9-5-3-6-10-16)21-19(20-15)17-11-7-4-8-12-17/h3-13H,14H2,1-2H3
InChIKeyKVQUKSFPPRUDAF-UHFFFAOYSA-N
XLogP4.09
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Diamino-5-phenyl-6-ethylpyrimidine, 2,4-
CID 93114
4-Phenylpyrimidine
CID 18923
4,6-Diphenylpyrimidin-2-amine
CID 619024
N-Benzyl-2-phenyl-4-quinazolinamine
CID 780643
N2,N4-Dibenzylquinazoline-2,4-diamine
CID 676352
2-Amino-4-phenylpyrimidine
CID 598777
2-Chloro-4,6-diphenylpyrimidine
CID 1804739
Revaprazan
CID 204104
Importazole
CID 2949965
4-Bromo-2,6-diphenylpyrimidine
CID 817533
2-Pyridinamine, 6-methyl-N-(phenylmethyl)-
CID 112445
4-Chloro-6-methyl-2-phenylpyrimidine
CID 598255

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N,6-dimethyl-2-phenylpyrimidin-4-amine?
The IUPAC name of N-benzyl-N,6-dimethyl-2-phenylpyrimidin-4-amine (CID 746584) is N-benzyl-N,6-dimethyl-2-phenylpyrimidin-4-amine.
What is the SMILES notation for N-benzyl-N,6-dimethyl-2-phenylpyrimidin-4-amine?
The canonical SMILES for N-benzyl-N,6-dimethyl-2-phenylpyrimidin-4-amine is Cc1cc(N(C)Cc2ccccc2)nc(-c2ccccc2)n1.
What is the InChIKey of N-benzyl-N,6-dimethyl-2-phenylpyrimidin-4-amine?
The InChIKey is KVQUKSFPPRUDAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3/c1-15-13-18(22(2)14-16-9-5-3-6-10-16)21-19(20-15)17-11-7-4-8-12-17/h3-13H,14H2,1-2H3.
What are the key properties of N-benzyl-N,6-dimethyl-2-phenylpyrimidin-4-amine?
N-benzyl-N,6-dimethyl-2-phenylpyrimidin-4-amine has a molecular weight of 289.38 g/mol, XLogP of 4.09, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N,6-dimethyl-2-phenylpyrimidin-4-amine is sourced from PubChem (CID 746584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).