N-[4-(methoxymethyl)phenyl]-4-(3-morpholin-4-ylpropyl)piperidine-1-carboxamide

C21H33N3O3 — CID 119049868

IUPACN-[4-(methoxymethyl)phenyl]-4-(3-morpholin-4-ylpropyl)piperidine-1-carboxamide
SMILESCOCc1ccc(NC(=O)N2CCC(CCCN3CCOCC3)CC2)cc1
InChIInChI=1S/C21H33N3O3/c1-26-17-19-4-6-20(7-5-19)22-21(25)24-11-8-18(9-12-24)3-2-10-23-13-15-27-16-14-23/h4-7,18H,2-3,8-17H2,1H3,(H,22,25)
InChIKeyCUDWAPMIRYYARU-UHFFFAOYSA-N
MW375.51 g/mol
LogP3.19
Rot. Bonds7

About N-[4-(methoxymethyl)phenyl]-4-(3-morpholin-4-ylpropyl)piperidine-1-carboxamide

N-[4-(methoxymethyl)phenyl]-4-(3-morpholin-4-ylpropyl)piperidine-1-carboxamide (PubChem CID 119049868) has the molecular formula C21H33N3O3 and a molecular weight of 375.51 g/mol. Its IUPAC name is N-[4-(methoxymethyl)phenyl]-4-(3-morpholin-4-ylpropyl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-[4-(methoxymethyl)phenyl]-4-(3-morpholin-4-ylpropyl)piperidine-1-carboxamide
PubChem CID119049868
Molecular FormulaC21H33N3O3
Molecular Weight375.51 g/mol
Exact Mass375.25
IUPAC NameN-[4-(methoxymethyl)phenyl]-4-(3-morpholin-4-ylpropyl)piperidine-1-carboxamide
SMILESCOCc1ccc(NC(=O)N2CCC(CCCN3CCOCC3)CC2)cc1
InChIInChI=1S/C21H33N3O3/c1-26-17-19-4-6-20(7-5-19)22-21(25)24-11-8-18(9-12-24)3-2-10-23-13-15-27-16-14-23/h4-7,18H,2-3,8-17H2,1H3,(H,22,25)
InChIKeyCUDWAPMIRYYARU-UHFFFAOYSA-N
XLogP3.19
TPSA54.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.51
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 2-[4-[[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]amino]phenyl]acetate
CID 20907510
N-[3-(methoxymethyl)phenyl]morpholine-4-carboxamide
CID 34684605
4-(cyclohexanecarbonylamino)-N-[4-(methoxymethyl)phenyl]piperidine-1-carboxamide
CID 119049838
4-[(4-tert-butylphenyl)methyl]-N-(4-methoxyphenyl)piperidine-1-carboxamide
CID 71958612
2-(cyclopropylmethylamino)-N-[4-(2-morpholin-4-ylethyl)phenyl]acetamide;dihydrochloride
CID 119860951
4-(methoxymethyl)-N-(4-methoxyphenyl)piperidine-1-carboxamide
CID 121091713
N-(4-acetamidophenyl)-4-(3-methoxypropyl)piperazine-1-carboxamide
CID 113105247
4-benzyl-N-[4-(2-morpholin-4-ylethyl)phenyl]piperazine-1-carboxamide
CID 60545892
N-[4-(morpholin-4-ylmethyl)phenyl]thiomorpholine-4-carboxamide
CID 134584192
N-(4-ethylphenyl)-4-(2-methoxyethyl)piperazine-1-carboxamide
CID 113104950
N-[4-(propylaminomethyl)phenyl]morpholine-4-carboxamide
CID 106911473
4-[2-(4-hydroxyphenyl)ethyl]-N-[1-(2-methoxyethyl)pyrazol-4-yl]piperidine-1-carboxamide
CID 55835858

Frequently Asked Questions

What is the IUPAC name of N-[4-(methoxymethyl)phenyl]-4-(3-morpholin-4-ylpropyl)piperidine-1-carboxamide?
The IUPAC name of N-[4-(methoxymethyl)phenyl]-4-(3-morpholin-4-ylpropyl)piperidine-1-carboxamide (CID 119049868) is N-[4-(methoxymethyl)phenyl]-4-(3-morpholin-4-ylpropyl)piperidine-1-carboxamide.
What is the SMILES notation for N-[4-(methoxymethyl)phenyl]-4-(3-morpholin-4-ylpropyl)piperidine-1-carboxamide?
The canonical SMILES for N-[4-(methoxymethyl)phenyl]-4-(3-morpholin-4-ylpropyl)piperidine-1-carboxamide is COCc1ccc(NC(=O)N2CCC(CCCN3CCOCC3)CC2)cc1.
What is the InChIKey of N-[4-(methoxymethyl)phenyl]-4-(3-morpholin-4-ylpropyl)piperidine-1-carboxamide?
The InChIKey is CUDWAPMIRYYARU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H33N3O3/c1-26-17-19-4-6-20(7-5-19)22-21(25)24-11-8-18(9-12-24)3-2-10-23-13-15-27-16-14-23/h4-7,18H,2-3,8-17H2,1H3,(H,22,25).
What are the key properties of N-[4-(methoxymethyl)phenyl]-4-(3-morpholin-4-ylpropyl)piperidine-1-carboxamide?
N-[4-(methoxymethyl)phenyl]-4-(3-morpholin-4-ylpropyl)piperidine-1-carboxamide has a molecular weight of 375.51 g/mol, XLogP of 3.19, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(methoxymethyl)phenyl]-4-(3-morpholin-4-ylpropyl)piperidine-1-carboxamide is sourced from PubChem (CID 119049868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).