N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyridin-2-amine

C21H26N6O2 — CID 170394468

IUPACN-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyridin-2-amine
SMILESc1ccc(NC2CCC(Oc3nc(N4CCOCC4)cc4nccn34)CC2)nc1
InChIInChI=1S/C21H26N6O2/c1-2-8-22-18(3-1)24-16-4-6-17(7-5-16)29-21-25-20(26-11-13-28-14-12-26)15-19-23-9-10-27(19)21/h1-3,8-10,15-17H,4-7,11-14H2,(H,22,24)
InChIKeyWERNSESWYXNVMP-UHFFFAOYSA-N
MW394.48 g/mol
LogP2.76
Rot. Bonds5

About N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyridin-2-amine

N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyridin-2-amine (PubChem CID 170394468) has the molecular formula C21H26N6O2 and a molecular weight of 394.48 g/mol. Its IUPAC name is N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyridin-2-amine.

Molecular Properties

Compound NameN-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyridin-2-amine
PubChem CID170394468
Molecular FormulaC21H26N6O2
Molecular Weight394.48 g/mol
Exact Mass394.21
IUPAC NameN-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyridin-2-amine
SMILESc1ccc(NC2CCC(Oc3nc(N4CCOCC4)cc4nccn34)CC2)nc1
InChIInChI=1S/C21H26N6O2/c1-2-8-22-18(3-1)24-16-4-6-17(7-5-16)29-21-25-20(26-11-13-28-14-12-26)15-19-23-9-10-27(19)21/h1-3,8-10,15-17H,4-7,11-14H2,(H,22,24)
InChIKeyWERNSESWYXNVMP-UHFFFAOYSA-N
XLogP2.76
TPSA76.81 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.48
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyridin-2-amine?
The IUPAC name of N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyridin-2-amine (CID 170394468) is N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyridin-2-amine.
What is the SMILES notation for N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyridin-2-amine?
The canonical SMILES for N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyridin-2-amine is c1ccc(NC2CCC(Oc3nc(N4CCOCC4)cc4nccn34)CC2)nc1.
What is the InChIKey of N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyridin-2-amine?
The InChIKey is WERNSESWYXNVMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N6O2/c1-2-8-22-18(3-1)24-16-4-6-17(7-5-16)29-21-25-20(26-11-13-28-14-12-26)15-19-23-9-10-27(19)21/h1-3,8-10,15-17H,4-7,11-14H2,(H,22,24).
What are the key properties of N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyridin-2-amine?
N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyridin-2-amine has a molecular weight of 394.48 g/mol, XLogP of 2.76, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyridin-2-amine is sourced from PubChem (CID 170394468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).