N-(4-cyclohexylphenyl)-2-[(2R)-2-methylmorpholin-4-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine

C24H32N4O — CID 177318695

IUPACN-(4-cyclohexylphenyl)-2-[(2R)-2-methylmorpholin-4-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
SMILESC[C@@H]1CN(c2nc3c(c(Nc4ccc(C5CCCCC5)cc4)n2)CCC3)CCO1
InChIInChI=1S/C24H32N4O/c1-17-16-28(14-15-29-17)24-26-22-9-5-8-21(22)23(27-24)25-20-12-10-19(11-13-20)18-6-3-2-4-7-18/h10-13,17-18H,2-9,14-16H2,1H3,(H,25,26,27)/t17-/m1/s1
InChIKeyIIQCQYNSBIEUHM-QGZVFWFLSA-N
MW392.55 g/mol
LogP4.98
Rot. Bonds4

About N-(4-cyclohexylphenyl)-2-[(2R)-2-methylmorpholin-4-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine

N-(4-cyclohexylphenyl)-2-[(2R)-2-methylmorpholin-4-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine (PubChem CID 177318695) has the molecular formula C24H32N4O and a molecular weight of 392.55 g/mol. Its IUPAC name is N-(4-cyclohexylphenyl)-2-[(2R)-2-methylmorpholin-4-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-(4-cyclohexylphenyl)-2-[(2R)-2-methylmorpholin-4-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
PubChem CID177318695
Molecular FormulaC24H32N4O
Molecular Weight392.55 g/mol
Exact Mass392.26
IUPAC NameN-(4-cyclohexylphenyl)-2-[(2R)-2-methylmorpholin-4-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
SMILESC[C@@H]1CN(c2nc3c(c(Nc4ccc(C5CCCCC5)cc4)n2)CCC3)CCO1
InChIInChI=1S/C24H32N4O/c1-17-16-28(14-15-29-17)24-26-22-9-5-8-21(22)23(27-24)25-20-12-10-19(11-13-20)18-6-3-2-4-7-18/h10-13,17-18H,2-9,14-16H2,1H3,(H,25,26,27)/t17-/m1/s1
InChIKeyIIQCQYNSBIEUHM-QGZVFWFLSA-N
XLogP4.98
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.55
LogP ≤ 54.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(4-cyclohexylphenyl)-2-[(2R)-2-methylmorpholin-4-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine with MolForge

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Related Compounds

N-(4-cyclohexylphenyl)-2-(2-methylmorpholin-4-yl)-6-propan-2-yl-5,7-dihydropyrrolo[3,4-d]pyrimidin-4-amine
CID 166732176
N-(4-cyclohexylphenyl)-2-(2-cyclopropylmorpholin-4-yl)-6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-4-amine
CID 156852615
6-[(butan-2-ylamino)methyl]-N-(4-cyclohexylphenyl)-5-methyl-2-morpholin-4-ylpyrimidin-4-amine
CID 170244118
N-(4-cyclopropylphenyl)-2-morpholin-4-yl-7-[3-(trifluoromethyl)-2-pyridinyl]-5,6,8,9-tetrahydropyrimido[4,5-d]azepin-4-amine;methylcarbamic acid
CID 90107395
N-[4-(2,6-dimethylmorpholin-4-yl)phenyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 138038412
(3S,4S)-4-(1,3-benzodioxol-5-yl)-1-[4-(methylamino)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl]piperidin-3-ol
CID 50952268
4-(2-methylmorpholin-4-yl)-6-piperidin-1-yl-1,3,5-triazin-2-amine
CID 80763914
2-[4-[[(5R)-2-[3-(4-chlorophenyl)pyrrolidin-1-yl]-5-oxo-7,8-dihydro-6H-thiopyrano[3,2-d]pyrimidin-4-yl]amino]phenyl]acetic acid
CID 178120964
N-methyl-4-(2-methylmorpholin-4-yl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine
CID 80763829
4-(4,6-dimethoxy-1,3,5-triazin-2-yl)-2-methylmorpholine
CID 67190024
2-[4-[[2-[4-(4-fluorophenyl)piperidin-1-yl]-5,5-dioxo-7,8-dihydro-6H-thiopyrano[3,2-d]pyrimidin-4-yl]amino]phenyl]acetic acid
CID 178121004
2-cyclopentyloxy-N-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 141401147

Frequently Asked Questions

What is the IUPAC name of N-(4-cyclohexylphenyl)-2-[(2R)-2-methylmorpholin-4-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The IUPAC name of N-(4-cyclohexylphenyl)-2-[(2R)-2-methylmorpholin-4-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine (CID 177318695) is N-(4-cyclohexylphenyl)-2-[(2R)-2-methylmorpholin-4-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine.
What is the SMILES notation for N-(4-cyclohexylphenyl)-2-[(2R)-2-methylmorpholin-4-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The canonical SMILES for N-(4-cyclohexylphenyl)-2-[(2R)-2-methylmorpholin-4-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine is C[C@@H]1CN(c2nc3c(c(Nc4ccc(C5CCCCC5)cc4)n2)CCC3)CCO1.
What is the InChIKey of N-(4-cyclohexylphenyl)-2-[(2R)-2-methylmorpholin-4-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The InChIKey is IIQCQYNSBIEUHM-QGZVFWFLSA-N. The full InChI is InChI=1S/C24H32N4O/c1-17-16-28(14-15-29-17)24-26-22-9-5-8-21(22)23(27-24)25-20-12-10-19(11-13-20)18-6-3-2-4-7-18/h10-13,17-18H,2-9,14-16H2,1H3,(H,25,26,27)/t17-/m1/s1.
What are the key properties of N-(4-cyclohexylphenyl)-2-[(2R)-2-methylmorpholin-4-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
N-(4-cyclohexylphenyl)-2-[(2R)-2-methylmorpholin-4-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine has a molecular weight of 392.55 g/mol, XLogP of 4.98, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyclohexylphenyl)-2-[(2R)-2-methylmorpholin-4-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine is sourced from PubChem (CID 177318695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).