N-[[4-(4-propan-2-yloxypyrimidin-2-yl)morpholin-3-yl]methyl]cyclopropanamine

C15H24N4O2 — CID 115975665

IUPACN-[[4-(4-propan-2-yloxypyrimidin-2-yl)morpholin-3-yl]methyl]cyclopropanamine
SMILESCC(C)Oc1ccnc(N2CCOCC2CNC2CC2)n1
InChIInChI=1S/C15H24N4O2/c1-11(2)21-14-5-6-16-15(18-14)19-7-8-20-10-13(19)9-17-12-3-4-12/h5-6,11-13,17H,3-4,7-10H2,1-2H3
InChIKeyQHICBXOOSRTNOI-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.22
Rot. Bonds6

About N-[[4-(4-propan-2-yloxypyrimidin-2-yl)morpholin-3-yl]methyl]cyclopropanamine

N-[[4-(4-propan-2-yloxypyrimidin-2-yl)morpholin-3-yl]methyl]cyclopropanamine (PubChem CID 115975665) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-[[4-(4-propan-2-yloxypyrimidin-2-yl)morpholin-3-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[4-(4-propan-2-yloxypyrimidin-2-yl)morpholin-3-yl]methyl]cyclopropanamine
PubChem CID115975665
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC NameN-[[4-(4-propan-2-yloxypyrimidin-2-yl)morpholin-3-yl]methyl]cyclopropanamine
SMILESCC(C)Oc1ccnc(N2CCOCC2CNC2CC2)n1
InChIInChI=1S/C15H24N4O2/c1-11(2)21-14-5-6-16-15(18-14)19-7-8-20-10-13(19)9-17-12-3-4-12/h5-6,11-13,17H,3-4,7-10H2,1-2H3
InChIKeyQHICBXOOSRTNOI-UHFFFAOYSA-N
XLogP1.22
TPSA59.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[[4-(4-propan-2-yloxypyrimidin-2-yl)morpholin-3-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[4-(4-propan-2-yloxypyrimidin-2-yl)morpholin-3-yl]methyl]cyclopropanamine (CID 115975665) is N-[[4-(4-propan-2-yloxypyrimidin-2-yl)morpholin-3-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[4-(4-propan-2-yloxypyrimidin-2-yl)morpholin-3-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[4-(4-propan-2-yloxypyrimidin-2-yl)morpholin-3-yl]methyl]cyclopropanamine is CC(C)Oc1ccnc(N2CCOCC2CNC2CC2)n1.
What is the InChIKey of N-[[4-(4-propan-2-yloxypyrimidin-2-yl)morpholin-3-yl]methyl]cyclopropanamine?
The InChIKey is QHICBXOOSRTNOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-11(2)21-14-5-6-16-15(18-14)19-7-8-20-10-13(19)9-17-12-3-4-12/h5-6,11-13,17H,3-4,7-10H2,1-2H3.
What are the key properties of N-[[4-(4-propan-2-yloxypyrimidin-2-yl)morpholin-3-yl]methyl]cyclopropanamine?
N-[[4-(4-propan-2-yloxypyrimidin-2-yl)morpholin-3-yl]methyl]cyclopropanamine has a molecular weight of 292.38 g/mol, XLogP of 1.22, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(4-propan-2-yloxypyrimidin-2-yl)morpholin-3-yl]methyl]cyclopropanamine is sourced from PubChem (CID 115975665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).