N-[4-(4-morpholin-4-ylpiperidin-1-yl)phenyl]formamide

C16H23N3O2 — CID 172863969

IUPACN-[4-(4-morpholin-4-ylpiperidin-1-yl)phenyl]formamide
SMILESO=CNc1ccc(N2CCC(N3CCOCC3)CC2)cc1
InChIInChI=1S/C16H23N3O2/c20-13-17-14-1-3-15(4-2-14)18-7-5-16(6-8-18)19-9-11-21-12-10-19/h1-4,13,16H,5-12H2,(H,17,20)
InChIKeyZSRDNBJMMPUAFC-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.56
Rot. Bonds4

About N-[4-(4-morpholin-4-ylpiperidin-1-yl)phenyl]formamide

N-[4-(4-morpholin-4-ylpiperidin-1-yl)phenyl]formamide (PubChem CID 172863969) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is N-[4-(4-morpholin-4-ylpiperidin-1-yl)phenyl]formamide.

Molecular Properties

Compound NameN-[4-(4-morpholin-4-ylpiperidin-1-yl)phenyl]formamide
PubChem CID172863969
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC NameN-[4-(4-morpholin-4-ylpiperidin-1-yl)phenyl]formamide
SMILESO=CNc1ccc(N2CCC(N3CCOCC3)CC2)cc1
InChIInChI=1S/C16H23N3O2/c20-13-17-14-1-3-15(4-2-14)18-7-5-16(6-8-18)19-9-11-21-12-10-19/h1-4,13,16H,5-12H2,(H,17,20)
InChIKeyZSRDNBJMMPUAFC-UHFFFAOYSA-N
XLogP1.56
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

N-[4-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]phenyl]formamide
CID 169085664
N-[4-(4-cyclohexylpiperazin-1-yl)phenyl]formamide
CID 58958425
N-[4-(4-methoxypiperidin-1-yl)phenyl]formamide
CID 168651911
5-(4-morpholin-4-ylpiperidin-1-yl)pyridin-2-amine
CID 67513413
4-[1-(4-ethyl-3-methoxyphenyl)piperidin-4-yl]morpholine
CID 135300472
[2-methoxy-5-(4-morpholin-4-ylpiperidin-1-yl)phenyl]-oxoazanium
CID 142939386
1-(4-morpholin-4-ylphenyl)piperidin-4-amine
CID 63180022
2-isocyano-4-(4-morpholin-4-ylpiperidin-1-yl)aniline
CID 21018337
N-[4-[4-(oxan-4-yl)piperazin-1-yl]phenyl]pyrimidin-2-amine
CID 141441950
N-[4-[3-[(E)-3-methylbut-1-enyl]-2-(4-morpholin-4-ylphenyl)imino-1,3-thiazolidin-5-yl]phenyl]formamide
CID 142861611
N-[4-methyl-3-[1-(4-morpholin-4-ylphenyl)ethenyl]phenyl]formamide
CID 134567230
4-[1-(3,5-dimethyl-4-nitrophenyl)piperidin-4-yl]morpholine
CID 144594517

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-morpholin-4-ylpiperidin-1-yl)phenyl]formamide?
The IUPAC name of N-[4-(4-morpholin-4-ylpiperidin-1-yl)phenyl]formamide (CID 172863969) is N-[4-(4-morpholin-4-ylpiperidin-1-yl)phenyl]formamide.
What is the SMILES notation for N-[4-(4-morpholin-4-ylpiperidin-1-yl)phenyl]formamide?
The canonical SMILES for N-[4-(4-morpholin-4-ylpiperidin-1-yl)phenyl]formamide is O=CNc1ccc(N2CCC(N3CCOCC3)CC2)cc1.
What is the InChIKey of N-[4-(4-morpholin-4-ylpiperidin-1-yl)phenyl]formamide?
The InChIKey is ZSRDNBJMMPUAFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c20-13-17-14-1-3-15(4-2-14)18-7-5-16(6-8-18)19-9-11-21-12-10-19/h1-4,13,16H,5-12H2,(H,17,20).
What are the key properties of N-[4-(4-morpholin-4-ylpiperidin-1-yl)phenyl]formamide?
N-[4-(4-morpholin-4-ylpiperidin-1-yl)phenyl]formamide has a molecular weight of 289.38 g/mol, XLogP of 1.56, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-morpholin-4-ylpiperidin-1-yl)phenyl]formamide is sourced from PubChem (CID 172863969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).