N-phenyl-4-[(4R)-2,2,4,6-tetramethyl-3,4-dihydro-1H-quinolin-7-yl]pyrimidin-2-amine

C23H26N4 — CID 125461748

IUPACN-phenyl-4-[(4R)-2,2,4,6-tetramethyl-3,4-dihydro-1H-quinolin-7-yl]pyrimidin-2-amine
SMILESCc1cc2c(cc1-c1ccnc(Nc3ccccc3)n1)NC(C)(C)C[C@H]2C
InChIInChI=1S/C23H26N4/c1-15-12-18-16(2)14-23(3,4)27-21(18)13-19(15)20-10-11-24-22(26-20)25-17-8-6-5-7-9-17/h5-13,16,27H,14H2,1-4H3,(H,24,25,26)/t16-/m1/s1
InChIKeyGQOHOOVCAXXTGH-MRXNPFEDSA-N
MW358.49 g/mol
LogP5.89
Rot. Bonds3

About N-phenyl-4-[(4R)-2,2,4,6-tetramethyl-3,4-dihydro-1H-quinolin-7-yl]pyrimidin-2-amine

N-phenyl-4-[(4R)-2,2,4,6-tetramethyl-3,4-dihydro-1H-quinolin-7-yl]pyrimidin-2-amine (PubChem CID 125461748) has the molecular formula C23H26N4 and a molecular weight of 358.49 g/mol. Its IUPAC name is N-phenyl-4-[(4R)-2,2,4,6-tetramethyl-3,4-dihydro-1H-quinolin-7-yl]pyrimidin-2-amine.

Molecular Properties

Compound NameN-phenyl-4-[(4R)-2,2,4,6-tetramethyl-3,4-dihydro-1H-quinolin-7-yl]pyrimidin-2-amine
PubChem CID125461748
Molecular FormulaC23H26N4
Molecular Weight358.49 g/mol
Exact Mass358.22
IUPAC NameN-phenyl-4-[(4R)-2,2,4,6-tetramethyl-3,4-dihydro-1H-quinolin-7-yl]pyrimidin-2-amine
SMILESCc1cc2c(cc1-c1ccnc(Nc3ccccc3)n1)NC(C)(C)C[C@H]2C
InChIInChI=1S/C23H26N4/c1-15-12-18-16(2)14-23(3,4)27-21(18)13-19(15)20-10-11-24-22(26-20)25-17-8-6-5-7-9-17/h5-13,16,27H,14H2,1-4H3,(H,24,25,26)/t16-/m1/s1
InChIKeyGQOHOOVCAXXTGH-MRXNPFEDSA-N
XLogP5.89
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.49
LogP ≤ 55.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-phenyl-4-[(4R)-2,2,4,6-tetramethyl-3,4-dihydro-1H-quinolin-7-yl]pyrimidin-2-amine 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

N-(4-chlorophenyl)-4-[(4S)-2,2,4,7-tetramethyl-3,4-dihydro-1H-quinolin-6-yl]pyrimidin-2-amine
CID 125461812
N-(4-chlorophenyl)-4-(2,2,4,7-tetramethyl-3,4-dihydro-1H-quinolin-6-yl)pyrimidin-2-amine
CID 122714408
4-naphthalen-2-yl-N-phenylpyrimidin-2-amine
CID 66493679
N-(3-methylphenyl)-4-phenylpyrimidin-2-amine
CID 20772097
4-(4-chloro-2-pyridinyl)-N-phenylpyrimidin-2-amine
CID 71233786
2-[[4-(2,5-dimethylphenyl)pyrimidin-2-yl]amino]phenol
CID 91294272
4-(5-methoxy-1H-indol-3-yl)-N-phenylpyrimidin-2-amine
CID 70148912
4-(1-methylpyrazol-4-yl)-N-phenylpyrimidin-2-amine
CID 104609504
4-[5-(2-chlorophenyl)-1H-pyrazol-4-yl]-N-[4-[[(2,2,6,6-tetramethylpiperidin-4-yl)amino]methyl]phenyl]pyrimidin-2-amine
CID 91440731
7-amino-4-(2-anilinopyrimidin-4-yl)-2,3-dihydroinden-1-one
CID 162008137
4-(1H-indol-3-yl)-N-(3-methylphenyl)pyrimidin-2-amine
CID 15653057
ethane;N-phenyl-4-pyrazolo[1,5-b]pyridazin-3-ylpyrimidin-2-amine
CID 91103828

Frequently Asked Questions

What is the IUPAC name of N-phenyl-4-[(4R)-2,2,4,6-tetramethyl-3,4-dihydro-1H-quinolin-7-yl]pyrimidin-2-amine?
The IUPAC name of N-phenyl-4-[(4R)-2,2,4,6-tetramethyl-3,4-dihydro-1H-quinolin-7-yl]pyrimidin-2-amine (CID 125461748) is N-phenyl-4-[(4R)-2,2,4,6-tetramethyl-3,4-dihydro-1H-quinolin-7-yl]pyrimidin-2-amine.
What is the SMILES notation for N-phenyl-4-[(4R)-2,2,4,6-tetramethyl-3,4-dihydro-1H-quinolin-7-yl]pyrimidin-2-amine?
The canonical SMILES for N-phenyl-4-[(4R)-2,2,4,6-tetramethyl-3,4-dihydro-1H-quinolin-7-yl]pyrimidin-2-amine is Cc1cc2c(cc1-c1ccnc(Nc3ccccc3)n1)NC(C)(C)C[C@H]2C.
What is the InChIKey of N-phenyl-4-[(4R)-2,2,4,6-tetramethyl-3,4-dihydro-1H-quinolin-7-yl]pyrimidin-2-amine?
The InChIKey is GQOHOOVCAXXTGH-MRXNPFEDSA-N. The full InChI is InChI=1S/C23H26N4/c1-15-12-18-16(2)14-23(3,4)27-21(18)13-19(15)20-10-11-24-22(26-20)25-17-8-6-5-7-9-17/h5-13,16,27H,14H2,1-4H3,(H,24,25,26)/t16-/m1/s1.
What are the key properties of N-phenyl-4-[(4R)-2,2,4,6-tetramethyl-3,4-dihydro-1H-quinolin-7-yl]pyrimidin-2-amine?
N-phenyl-4-[(4R)-2,2,4,6-tetramethyl-3,4-dihydro-1H-quinolin-7-yl]pyrimidin-2-amine has a molecular weight of 358.49 g/mol, XLogP of 5.89, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-4-[(4R)-2,2,4,6-tetramethyl-3,4-dihydro-1H-quinolin-7-yl]pyrimidin-2-amine is sourced from PubChem (CID 125461748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).