N-[2-(diethylamino)-3-phenylpropyl]morpholine-3-carboxamide

C18H29N3O2 — CID 119849942

IUPACN-[2-(diethylamino)-3-phenylpropyl]morpholine-3-carboxamide
SMILESCCN(CC)C(CNC(=O)C1COCCN1)Cc1ccccc1
InChIInChI=1S/C18H29N3O2/c1-3-21(4-2)16(12-15-8-6-5-7-9-15)13-20-18(22)17-14-23-11-10-19-17/h5-9,16-17,19H,3-4,10-14H2,1-2H3,(H,20,22)
InChIKeySJQGNKPYJUQKTA-UHFFFAOYSA-N
MW319.45 g/mol
LogP1.04
Rot. Bonds8

About N-[2-(diethylamino)-3-phenylpropyl]morpholine-3-carboxamide

N-[2-(diethylamino)-3-phenylpropyl]morpholine-3-carboxamide (PubChem CID 119849942) has the molecular formula C18H29N3O2 and a molecular weight of 319.45 g/mol. Its IUPAC name is N-[2-(diethylamino)-3-phenylpropyl]morpholine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(diethylamino)-3-phenylpropyl]morpholine-3-carboxamide
PubChem CID119849942
Molecular FormulaC18H29N3O2
Molecular Weight319.45 g/mol
Exact Mass319.23
IUPAC NameN-[2-(diethylamino)-3-phenylpropyl]morpholine-3-carboxamide
SMILESCCN(CC)C(CNC(=O)C1COCCN1)Cc1ccccc1
InChIInChI=1S/C18H29N3O2/c1-3-21(4-2)16(12-15-8-6-5-7-9-15)13-20-18(22)17-14-23-11-10-19-17/h5-9,16-17,19H,3-4,10-14H2,1-2H3,(H,20,22)
InChIKeySJQGNKPYJUQKTA-UHFFFAOYSA-N
XLogP1.04
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.45
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(diethylamino)-3-phenylpropyl]piperidine-2-carboxamide;dihydrochloride
CID 119849955
(3R)-N-[(2S)-2,3-diphenylpropyl]morpholine-3-carboxamide
CID 124699410
N-(2-phenylsulfanylpropyl)morpholine-3-carboxamide;hydrochloride
CID 119804403
N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]morpholine-3-carboxamide
CID 107861025
(3R)-N-[(2R)-2-(2-fluorophenyl)-2-hydroxyethyl]morpholine-3-carboxamide
CID 124588211
2-[2-[(morpholine-3-carbonylamino)methyl]phenyl]acetic acid
CID 81317493
N-(1,1,1-trifluoro-3-phenylpropan-2-yl)morpholine-3-carboxamide;hydrochloride
CID 119801822
N-[3-(dibenzylamino)propyl]morpholine-3-carboxamide
CID 119897262
(3R)-N-ethylmorpholine-3-carboxamide
CID 96578732
N-[1-(benzylamino)-1-oxopropan-2-yl]morpholine-3-carboxamide;hydrochloride
CID 119750954
N-(2-phenyl-2-pyrrolidin-1-ylethyl)morpholine-3-carboxamide;dihydrochloride
CID 119831374
N-[[3-[[ethyl(methyl)amino]methyl]phenyl]methyl]morpholine-3-carboxamide;dihydrochloride
CID 119862520

Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)-3-phenylpropyl]morpholine-3-carboxamide?
The IUPAC name of N-[2-(diethylamino)-3-phenylpropyl]morpholine-3-carboxamide (CID 119849942) is N-[2-(diethylamino)-3-phenylpropyl]morpholine-3-carboxamide.
What is the SMILES notation for N-[2-(diethylamino)-3-phenylpropyl]morpholine-3-carboxamide?
The canonical SMILES for N-[2-(diethylamino)-3-phenylpropyl]morpholine-3-carboxamide is CCN(CC)C(CNC(=O)C1COCCN1)Cc1ccccc1.
What is the InChIKey of N-[2-(diethylamino)-3-phenylpropyl]morpholine-3-carboxamide?
The InChIKey is SJQGNKPYJUQKTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N3O2/c1-3-21(4-2)16(12-15-8-6-5-7-9-15)13-20-18(22)17-14-23-11-10-19-17/h5-9,16-17,19H,3-4,10-14H2,1-2H3,(H,20,22).
What are the key properties of N-[2-(diethylamino)-3-phenylpropyl]morpholine-3-carboxamide?
N-[2-(diethylamino)-3-phenylpropyl]morpholine-3-carboxamide has a molecular weight of 319.45 g/mol, XLogP of 1.04, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)-3-phenylpropyl]morpholine-3-carboxamide is sourced from PubChem (CID 119849942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).