N-[3-[(6R)-2,2,6-trimethylmorpholine-4-carbonyl]naphthalen-2-yl]cyclopropanecarboxamide

C22H26N2O3 — CID 95159007

IUPACN-[3-[(6R)-2,2,6-trimethylmorpholine-4-carbonyl]naphthalen-2-yl]cyclopropanecarboxamide
SMILESC[C@@H]1CN(C(=O)c2cc3ccccc3cc2NC(=O)C2CC2)CC(C)(C)O1
InChIInChI=1S/C22H26N2O3/c1-14-12-24(13-22(2,3)27-14)21(26)18-10-16-6-4-5-7-17(16)11-19(18)23-20(25)15-8-9-15/h4-7,10-11,14-15H,8-9,12-13H2,1-3H3,(H,23,25)/t14-/m1/s1
InChIKeyLACNYSIBMKRUPP-CQSZACIVSA-N
MW366.46 g/mol
LogP3.83
Rot. Bonds3

About N-[3-[(6R)-2,2,6-trimethylmorpholine-4-carbonyl]naphthalen-2-yl]cyclopropanecarboxamide

N-[3-[(6R)-2,2,6-trimethylmorpholine-4-carbonyl]naphthalen-2-yl]cyclopropanecarboxamide (PubChem CID 95159007) has the molecular formula C22H26N2O3 and a molecular weight of 366.46 g/mol. Its IUPAC name is N-[3-[(6R)-2,2,6-trimethylmorpholine-4-carbonyl]naphthalen-2-yl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[3-[(6R)-2,2,6-trimethylmorpholine-4-carbonyl]naphthalen-2-yl]cyclopropanecarboxamide
PubChem CID95159007
Molecular FormulaC22H26N2O3
Molecular Weight366.46 g/mol
Exact Mass366.19
IUPAC NameN-[3-[(6R)-2,2,6-trimethylmorpholine-4-carbonyl]naphthalen-2-yl]cyclopropanecarboxamide
SMILESC[C@@H]1CN(C(=O)c2cc3ccccc3cc2NC(=O)C2CC2)CC(C)(C)O1
InChIInChI=1S/C22H26N2O3/c1-14-12-24(13-22(2,3)27-14)21(26)18-10-16-6-4-5-7-17(16)11-19(18)23-20(25)15-8-9-15/h4-7,10-11,14-15H,8-9,12-13H2,1-3H3,(H,23,25)/t14-/m1/s1
InChIKeyLACNYSIBMKRUPP-CQSZACIVSA-N
XLogP3.83
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.46
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2-hydrazinylphenyl)-(2,2,6-trimethylmorpholin-4-yl)methanone
CID 62249835
N-[3-(3-hydroxypiperidine-1-carbonyl)naphthalen-2-yl]cyclopropanecarboxamide
CID 110880058
[5-chloro-2-(methylamino)phenyl]-(2,2,6-trimethylmorpholin-4-yl)methanone
CID 62174797
3-(cyclopropanecarbonylamino)naphthalene-2-carboxylate
CID 7131661
(2,3-dihydroxyphenyl)-(2,2,6-trimethylmorpholin-4-yl)methanone
CID 114344244
N-[3-[4-(4-fluorophenyl)piperazine-1-carbonyl]naphthalen-2-yl]cyclopropanecarboxamide
CID 46689860
[5-chloro-2-(ethylamino)phenyl]-(2,2,6-trimethylmorpholin-4-yl)methanone
CID 62174798
3-(cyclopropanecarbonylamino)-N-[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-2-methylpropyl]naphthalene-2-carboxamide
CID 30889082
(2-fluoro-5-methylphenyl)-(2,2,6-trimethylmorpholin-4-yl)methanone
CID 62511546
(2-morpholin-4-ylphenyl)-[(6S)-2,2,6-trimethylmorpholin-4-yl]methanone
CID 95321116
N-[3-[4-(2-ethoxyphenyl)piperazine-1-carbonyl]naphthalen-2-yl]cyclopropanecarboxamide
CID 24663377
(5-amino-2-methylphenyl)-(2,2,6-trimethylmorpholin-4-yl)methanone;hydrochloride
CID 120625558

Frequently Asked Questions

What is the IUPAC name of N-[3-[(6R)-2,2,6-trimethylmorpholine-4-carbonyl]naphthalen-2-yl]cyclopropanecarboxamide?
The IUPAC name of N-[3-[(6R)-2,2,6-trimethylmorpholine-4-carbonyl]naphthalen-2-yl]cyclopropanecarboxamide (CID 95159007) is N-[3-[(6R)-2,2,6-trimethylmorpholine-4-carbonyl]naphthalen-2-yl]cyclopropanecarboxamide.
What is the SMILES notation for N-[3-[(6R)-2,2,6-trimethylmorpholine-4-carbonyl]naphthalen-2-yl]cyclopropanecarboxamide?
The canonical SMILES for N-[3-[(6R)-2,2,6-trimethylmorpholine-4-carbonyl]naphthalen-2-yl]cyclopropanecarboxamide is C[C@@H]1CN(C(=O)c2cc3ccccc3cc2NC(=O)C2CC2)CC(C)(C)O1.
What is the InChIKey of N-[3-[(6R)-2,2,6-trimethylmorpholine-4-carbonyl]naphthalen-2-yl]cyclopropanecarboxamide?
The InChIKey is LACNYSIBMKRUPP-CQSZACIVSA-N. The full InChI is InChI=1S/C22H26N2O3/c1-14-12-24(13-22(2,3)27-14)21(26)18-10-16-6-4-5-7-17(16)11-19(18)23-20(25)15-8-9-15/h4-7,10-11,14-15H,8-9,12-13H2,1-3H3,(H,23,25)/t14-/m1/s1.
What are the key properties of N-[3-[(6R)-2,2,6-trimethylmorpholine-4-carbonyl]naphthalen-2-yl]cyclopropanecarboxamide?
N-[3-[(6R)-2,2,6-trimethylmorpholine-4-carbonyl]naphthalen-2-yl]cyclopropanecarboxamide has a molecular weight of 366.46 g/mol, XLogP of 3.83, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(6R)-2,2,6-trimethylmorpholine-4-carbonyl]naphthalen-2-yl]cyclopropanecarboxamide is sourced from PubChem (CID 95159007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).