N-[4-(morpholine-4-carbonyl)phenyl]-3-piperidin-3-ylbutanamide

C20H29N3O3 — CID 119712378

IUPACN-[4-(morpholine-4-carbonyl)phenyl]-3-piperidin-3-ylbutanamide
SMILESCC(CC(=O)Nc1ccc(C(=O)N2CCOCC2)cc1)C1CCCNC1
InChIInChI=1S/C20H29N3O3/c1-15(17-3-2-8-21-14-17)13-19(24)22-18-6-4-16(5-7-18)20(25)23-9-11-26-12-10-23/h4-7,15,17,21H,2-3,8-14H2,1H3,(H,22,24)
InChIKeyVVFLOCJOPYUHSZ-UHFFFAOYSA-N
MW359.47 g/mol
LogP2.12
Rot. Bonds5

About N-[4-(morpholine-4-carbonyl)phenyl]-3-piperidin-3-ylbutanamide

N-[4-(morpholine-4-carbonyl)phenyl]-3-piperidin-3-ylbutanamide (PubChem CID 119712378) has the molecular formula C20H29N3O3 and a molecular weight of 359.47 g/mol. Its IUPAC name is N-[4-(morpholine-4-carbonyl)phenyl]-3-piperidin-3-ylbutanamide.

Molecular Properties

Compound NameN-[4-(morpholine-4-carbonyl)phenyl]-3-piperidin-3-ylbutanamide
PubChem CID119712378
Molecular FormulaC20H29N3O3
Molecular Weight359.47 g/mol
Exact Mass359.22
IUPAC NameN-[4-(morpholine-4-carbonyl)phenyl]-3-piperidin-3-ylbutanamide
SMILESCC(CC(=O)Nc1ccc(C(=O)N2CCOCC2)cc1)C1CCCNC1
InChIInChI=1S/C20H29N3O3/c1-15(17-3-2-8-21-14-17)13-19(24)22-18-6-4-16(5-7-18)20(25)23-9-11-26-12-10-23/h4-7,15,17,21H,2-3,8-14H2,1H3,(H,22,24)
InChIKeyVVFLOCJOPYUHSZ-UHFFFAOYSA-N
XLogP2.12
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.47
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(morpholine-4-carbonyl)phenyl]-3-piperidin-3-ylbutanamide;hydrochloride
CID 119712326
N-[4-(1-morpholin-4-ylethyl)phenyl]-3-piperidin-3-ylbutanamide;dihydrochloride
CID 119878401
N-[2-methyl-3-(morpholine-4-carbonyl)phenyl]-3-piperidin-3-ylbutanamide
CID 119750611
N-[4-(3-piperidin-3-ylbutanoylamino)phenyl]azepane-1-carboxamide;hydrochloride
CID 119761516
N,N-dimethyl-4-(3-piperidin-3-ylbutanoylamino)benzamide
CID 119684908
N-(4-bromophenyl)-3-piperidin-3-ylbutanamide;hydrochloride
CID 119670352
4-(3-piperidin-3-ylbutanoylamino)-N-(2-pyrrolidin-1-ylethyl)benzamide
CID 119885625
N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]-3-piperidin-3-ylbutanamide
CID 119749370
N-(4-methoxyphenyl)-3-piperidin-3-ylbutanamide;hydrochloride
CID 119670993
N-[4-(2-oxoimidazolidin-1-yl)phenyl]-3-piperidin-3-ylbutanamide
CID 119698584
N-[4-[3-(dimethylamino)propanoylamino]phenyl]-3-piperidin-3-ylbutanamide
CID 119868261
4-(3-piperidin-3-ylbutanoylamino)-N,N-bis(prop-2-enyl)benzamide;hydrochloride
CID 119739180

Frequently Asked Questions

What is the IUPAC name of N-[4-(morpholine-4-carbonyl)phenyl]-3-piperidin-3-ylbutanamide?
The IUPAC name of N-[4-(morpholine-4-carbonyl)phenyl]-3-piperidin-3-ylbutanamide (CID 119712378) is N-[4-(morpholine-4-carbonyl)phenyl]-3-piperidin-3-ylbutanamide.
What is the SMILES notation for N-[4-(morpholine-4-carbonyl)phenyl]-3-piperidin-3-ylbutanamide?
The canonical SMILES for N-[4-(morpholine-4-carbonyl)phenyl]-3-piperidin-3-ylbutanamide is CC(CC(=O)Nc1ccc(C(=O)N2CCOCC2)cc1)C1CCCNC1.
What is the InChIKey of N-[4-(morpholine-4-carbonyl)phenyl]-3-piperidin-3-ylbutanamide?
The InChIKey is VVFLOCJOPYUHSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29N3O3/c1-15(17-3-2-8-21-14-17)13-19(24)22-18-6-4-16(5-7-18)20(25)23-9-11-26-12-10-23/h4-7,15,17,21H,2-3,8-14H2,1H3,(H,22,24).
What are the key properties of N-[4-(morpholine-4-carbonyl)phenyl]-3-piperidin-3-ylbutanamide?
N-[4-(morpholine-4-carbonyl)phenyl]-3-piperidin-3-ylbutanamide has a molecular weight of 359.47 g/mol, XLogP of 2.12, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(morpholine-4-carbonyl)phenyl]-3-piperidin-3-ylbutanamide is sourced from PubChem (CID 119712378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).