N-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)-1-phenylcyclopropane-1-carboxamide

C18H26N2O3 — CID 111520008

IUPACN-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)-1-phenylcyclopropane-1-carboxamide
SMILESCC(O)(CNC(=O)C1(c2ccccc2)CC1)CN1CCOCC1
InChIInChI=1S/C18H26N2O3/c1-17(22,14-20-9-11-23-12-10-20)13-19-16(21)18(7-8-18)15-5-3-2-4-6-15/h2-6,22H,7-14H2,1H3,(H,19,21)
InChIKeyJSYMPJDPMWNRIH-UHFFFAOYSA-N
MW318.42 g/mol
LogP0.92
Rot. Bonds6

About N-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)-1-phenylcyclopropane-1-carboxamide

N-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)-1-phenylcyclopropane-1-carboxamide (PubChem CID 111520008) has the molecular formula C18H26N2O3 and a molecular weight of 318.42 g/mol. Its IUPAC name is N-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)-1-phenylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)-1-phenylcyclopropane-1-carboxamide
PubChem CID111520008
Molecular FormulaC18H26N2O3
Molecular Weight318.42 g/mol
Exact Mass318.19
IUPAC NameN-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)-1-phenylcyclopropane-1-carboxamide
SMILESCC(O)(CNC(=O)C1(c2ccccc2)CC1)CN1CCOCC1
InChIInChI=1S/C18H26N2O3/c1-17(22,14-20-9-11-23-12-10-20)13-19-16(21)18(7-8-18)15-5-3-2-4-6-15/h2-6,22H,7-14H2,1H3,(H,19,21)
InChIKeyJSYMPJDPMWNRIH-UHFFFAOYSA-N
XLogP0.92
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methyl-2-morpholin-4-ylpropyl)-1-phenylcyclopropane-1-carboxamide
CID 51173133
N-[[1-(morpholin-4-ylmethyl)cyclohexyl]methyl]-1-phenylcyclopropane-1-carboxamide
CID 126790169
N-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)naphthalene-2-carboxamide
CID 111519900
N-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)-3-phenylfuran-2-carboxamide
CID 111698273
1-benzyl-N-[(2R)-2-hydroxy-2-methyl-3-morpholin-4-ylpropyl]pyrrole-2-carboxamide
CID 95971967
N-(2,2-dimethylpropyl)-1-phenylcyclohexane-1-carboxamide
CID 110474016
N-(2-hydroxy-2-methylpropyl)-4-phenylpiperidine-4-carboxamide
CID 65106988
N-[(4-morpholin-4-ylphenyl)methyl]-4-phenyloxane-4-carboxamide
CID 56922873
N-(2-morpholin-4-ylethyl)-4-phenyl-1-(3-phenylpropanoyl)piperidine-4-carboxamide
CID 23600948
4-(4-fluorophenyl)-N-[3-(furan-2-yl)-2-hydroxy-2-methylpropyl]oxane-4-carboxamide
CID 90605098
N-[(4-morpholin-4-ylphenyl)methyl]-1-phenylcyclopentane-1-carboxamide
CID 56922098
N-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)-3,4,4-trimethylpentanamide
CID 111698275

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)-1-phenylcyclopropane-1-carboxamide?
The IUPAC name of N-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)-1-phenylcyclopropane-1-carboxamide (CID 111520008) is N-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)-1-phenylcyclopropane-1-carboxamide.
What is the SMILES notation for N-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)-1-phenylcyclopropane-1-carboxamide?
The canonical SMILES for N-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)-1-phenylcyclopropane-1-carboxamide is CC(O)(CNC(=O)C1(c2ccccc2)CC1)CN1CCOCC1.
What is the InChIKey of N-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)-1-phenylcyclopropane-1-carboxamide?
The InChIKey is JSYMPJDPMWNRIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O3/c1-17(22,14-20-9-11-23-12-10-20)13-19-16(21)18(7-8-18)15-5-3-2-4-6-15/h2-6,22H,7-14H2,1H3,(H,19,21).
What are the key properties of N-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)-1-phenylcyclopropane-1-carboxamide?
N-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)-1-phenylcyclopropane-1-carboxamide has a molecular weight of 318.42 g/mol, XLogP of 0.92, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-2-methyl-3-morpholin-4-ylpropyl)-1-phenylcyclopropane-1-carboxamide is sourced from PubChem (CID 111520008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).