N-[(2S)-3-methyl-2-morpholin-4-ylbutyl]naphthalene-2-carboxamide

C20H26N2O2 — CID 25497917

IUPACN-[(2S)-3-methyl-2-morpholin-4-ylbutyl]naphthalene-2-carboxamide
SMILESCC(C)[C@@H](CNC(=O)c1ccc2ccccc2c1)N1CCOCC1
InChIInChI=1S/C20H26N2O2/c1-15(2)19(22-9-11-24-12-10-22)14-21-20(23)18-8-7-16-5-3-4-6-17(16)13-18/h3-8,13,15,19H,9-12,14H2,1-2H3,(H,21,23)/t19-/m1/s1
InChIKeyPTRVZLDJDOYWRS-LJQANCHMSA-N
MW326.44 g/mol
LogP2.93
Rot. Bonds5

About N-[(2S)-3-methyl-2-morpholin-4-ylbutyl]naphthalene-2-carboxamide

N-[(2S)-3-methyl-2-morpholin-4-ylbutyl]naphthalene-2-carboxamide (PubChem CID 25497917) has the molecular formula C20H26N2O2 and a molecular weight of 326.44 g/mol. Its IUPAC name is N-[(2S)-3-methyl-2-morpholin-4-ylbutyl]naphthalene-2-carboxamide.

Molecular Properties

Compound NameN-[(2S)-3-methyl-2-morpholin-4-ylbutyl]naphthalene-2-carboxamide
PubChem CID25497917
Molecular FormulaC20H26N2O2
Molecular Weight326.44 g/mol
Exact Mass326.20
IUPAC NameN-[(2S)-3-methyl-2-morpholin-4-ylbutyl]naphthalene-2-carboxamide
SMILESCC(C)[C@@H](CNC(=O)c1ccc2ccccc2c1)N1CCOCC1
InChIInChI=1S/C20H26N2O2/c1-15(2)19(22-9-11-24-12-10-22)14-21-20(23)18-8-7-16-5-3-4-6-17(16)13-18/h3-8,13,15,19H,9-12,14H2,1-2H3,(H,21,23)/t19-/m1/s1
InChIKeyPTRVZLDJDOYWRS-LJQANCHMSA-N
XLogP2.93
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-(3-methyl-2-morpholin-4-ylbutyl)benzamide
CID 110402733
4-methyl-N-[(2S)-3-methyl-2-morpholin-4-ylbutyl]-3-pyrrolidin-1-ylbenzamide
CID 92626833
4-(4-fluorophenoxy)-N-[(2S)-3-methyl-2-morpholin-4-ylbutyl]benzamide
CID 32627981
N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]-4-nitrobenzamide
CID 30379685
3-(cyclopropanecarbonylamino)-N-(3-methyl-2-morpholin-4-ylbutyl)naphthalene-2-carboxamide
CID 55519412
2-methyl-1-(3-methyl-2-morpholin-4-ylbutyl)-3-(naphthalen-2-ylmethyl)guanidine;hydroiodide
CID 111930951
N-(3-methyl-2-morpholin-4-ylbutyl)-1-propanoyl-2,3-dihydroindole-5-carboxamide
CID 55788763
N-[4-[(3-methyl-2-morpholin-4-ylbutyl)carbamoyl]phenyl]furan-2-carboxamide
CID 18153813
N-[4-[[(2R)-3-methyl-2-morpholin-4-ylbutyl]carbamoyl]phenyl]thiophene-2-carboxamide
CID 25473941
5-fluoro-3-N-(3-methyl-2-morpholin-4-ylbutyl)benzene-1,3-dicarboxamide
CID 167837572
2-chloro-N-(3-ethyl-2-morpholin-4-ylpentyl)quinoline-6-carboxamide
CID 55731335
N-(3-methyl-2-morpholin-4-ylbutyl)-3-(pyridin-3-ylmethoxy)benzamide
CID 55775479

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-3-methyl-2-morpholin-4-ylbutyl]naphthalene-2-carboxamide?
The IUPAC name of N-[(2S)-3-methyl-2-morpholin-4-ylbutyl]naphthalene-2-carboxamide (CID 25497917) is N-[(2S)-3-methyl-2-morpholin-4-ylbutyl]naphthalene-2-carboxamide.
What is the SMILES notation for N-[(2S)-3-methyl-2-morpholin-4-ylbutyl]naphthalene-2-carboxamide?
The canonical SMILES for N-[(2S)-3-methyl-2-morpholin-4-ylbutyl]naphthalene-2-carboxamide is CC(C)[C@@H](CNC(=O)c1ccc2ccccc2c1)N1CCOCC1.
What is the InChIKey of N-[(2S)-3-methyl-2-morpholin-4-ylbutyl]naphthalene-2-carboxamide?
The InChIKey is PTRVZLDJDOYWRS-LJQANCHMSA-N. The full InChI is InChI=1S/C20H26N2O2/c1-15(2)19(22-9-11-24-12-10-22)14-21-20(23)18-8-7-16-5-3-4-6-17(16)13-18/h3-8,13,15,19H,9-12,14H2,1-2H3,(H,21,23)/t19-/m1/s1.
What are the key properties of N-[(2S)-3-methyl-2-morpholin-4-ylbutyl]naphthalene-2-carboxamide?
N-[(2S)-3-methyl-2-morpholin-4-ylbutyl]naphthalene-2-carboxamide has a molecular weight of 326.44 g/mol, XLogP of 2.93, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-3-methyl-2-morpholin-4-ylbutyl]naphthalene-2-carboxamide is sourced from PubChem (CID 25497917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).