N-(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-3-(2-hydroxypropyl)morpholine-4-carboxamide

C18H25FN2O3 — CID 86795803

IUPACN-(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-3-(2-hydroxypropyl)morpholine-4-carboxamide
SMILESCC(O)CC1COCCN1C(=O)NC1CCCc2ccc(F)cc21
InChIInChI=1S/C18H25FN2O3/c1-12(22)9-15-11-24-8-7-21(15)18(23)20-17-4-2-3-13-5-6-14(19)10-16(13)17/h5-6,10,12,15,17,22H,2-4,7-9,11H2,1H3,(H,20,23)
InChIKeyXNTCOOOPRCOQFE-UHFFFAOYSA-N
MW336.41 g/mol
LogP2.38
Rot. Bonds3

About N-(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-3-(2-hydroxypropyl)morpholine-4-carboxamide

N-(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-3-(2-hydroxypropyl)morpholine-4-carboxamide (PubChem CID 86795803) has the molecular formula C18H25FN2O3 and a molecular weight of 336.41 g/mol. Its IUPAC name is N-(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-3-(2-hydroxypropyl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-3-(2-hydroxypropyl)morpholine-4-carboxamide
PubChem CID86795803
Molecular FormulaC18H25FN2O3
Molecular Weight336.41 g/mol
Exact Mass336.18
IUPAC NameN-(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-3-(2-hydroxypropyl)morpholine-4-carboxamide
SMILESCC(O)CC1COCCN1C(=O)NC1CCCc2ccc(F)cc21
InChIInChI=1S/C18H25FN2O3/c1-12(22)9-15-11-24-8-7-21(15)18(23)20-17-4-2-3-13-5-6-14(19)10-16(13)17/h5-6,10,12,15,17,22H,2-4,7-9,11H2,1H3,(H,20,23)
InChIKeyXNTCOOOPRCOQFE-UHFFFAOYSA-N
XLogP2.38
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.41
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-3-(2-hydroxypropyl)morpholine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-Ethyl-1-(3-hydroxypropyl)-1-(1,2,3,4-tetrahydronaphthalen-1-yl)urea
CID 71857908
1-(3-Hydroxypropyl)-3-(2-morpholin-4-ylethyl)-1-(1,2,3,4-tetrahydronaphthalen-1-yl)urea
CID 71857909
(3S)-N-[(1R)-1-(2,3-difluorophenyl)ethyl]-3-[(2S)-2-hydroxypropyl]morpholine-4-carboxamide
CID 129429304
1-[4-[(6-Fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)amino]piperidin-1-yl]-3-methoxypropan-2-ol
CID 75497330
1-(7-Fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-3-(3-methyloxolan-3-yl)urea
CID 84595883
3-(2-hydroxypropyl)-N-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)morpholine-4-carboxamide
CID 86795747
3-(2-hydroxypropyl)-N-[(2-methylcyclopropyl)-phenylmethyl]morpholine-4-carboxamide
CID 86795783
3-(2-hydroxypropyl)-N-[[3-(trifluoromethyl)phenyl]methyl]morpholine-4-carboxamide
CID 91660761
1-(2-cyclopentyloxyethyl)-3-[(1S)-7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl]urea
CID 128187600
N-[1-(3,4-difluorophenyl)ethyl]-2-(hydroxymethyl)morpholine-4-carboxamide
CID 71861171
[(2R,4S)-1-[benzyl(methyl)carbamoyl]-2-(4-fluoro-2-methylphenyl)piperidin-4-yl] N-(2-hydroxyethyl)carbamate
CID 57939410
[1-carbamoyl-2-(4-fluoro-2-methylphenyl)piperidin-4-yl] N-(2-hydroxyethyl)carbamate
CID 68438553

Frequently Asked Questions

What is the IUPAC name of N-(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-3-(2-hydroxypropyl)morpholine-4-carboxamide?
The IUPAC name of N-(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-3-(2-hydroxypropyl)morpholine-4-carboxamide (CID 86795803) is N-(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-3-(2-hydroxypropyl)morpholine-4-carboxamide.
What is the SMILES notation for N-(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-3-(2-hydroxypropyl)morpholine-4-carboxamide?
The canonical SMILES for N-(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-3-(2-hydroxypropyl)morpholine-4-carboxamide is CC(O)CC1COCCN1C(=O)NC1CCCc2ccc(F)cc21.
What is the InChIKey of N-(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-3-(2-hydroxypropyl)morpholine-4-carboxamide?
The InChIKey is XNTCOOOPRCOQFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25FN2O3/c1-12(22)9-15-11-24-8-7-21(15)18(23)20-17-4-2-3-13-5-6-14(19)10-16(13)17/h5-6,10,12,15,17,22H,2-4,7-9,11H2,1H3,(H,20,23).
What are the key properties of N-(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-3-(2-hydroxypropyl)morpholine-4-carboxamide?
N-(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-3-(2-hydroxypropyl)morpholine-4-carboxamide has a molecular weight of 336.41 g/mol, XLogP of 2.38, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-3-(2-hydroxypropyl)morpholine-4-carboxamide is sourced from PubChem (CID 86795803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).