(3R)-2-methyl-N-(2-naphthalen-1-ylethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide

C22H29N3O — CID 95863233

IUPAC(3R)-2-methyl-N-(2-naphthalen-1-ylethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide
SMILESCN1CC2(CCNCC2)C[C@@H]1C(=O)NCCc1cccc2ccccc12
InChIInChI=1S/C22H29N3O/c1-25-16-22(10-13-23-14-11-22)15-20(25)21(26)24-12-9-18-7-4-6-17-5-2-3-8-19(17)18/h2-8,20,23H,9-16H2,1H3,(H,24,26)/t20-/m1/s1
InChIKeyZYWDCWJYZOILCU-HXUWFJFHSA-N
MW351.49 g/mol
LogP2.57
Rot. Bonds4

About (3R)-2-methyl-N-(2-naphthalen-1-ylethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide

(3R)-2-methyl-N-(2-naphthalen-1-ylethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide (PubChem CID 95863233) has the molecular formula C22H29N3O and a molecular weight of 351.49 g/mol. Its IUPAC name is (3R)-2-methyl-N-(2-naphthalen-1-ylethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide.

Molecular Properties

Compound Name(3R)-2-methyl-N-(2-naphthalen-1-ylethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide
PubChem CID95863233
Molecular FormulaC22H29N3O
Molecular Weight351.49 g/mol
Exact Mass351.23
IUPAC Name(3R)-2-methyl-N-(2-naphthalen-1-ylethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide
SMILESCN1CC2(CCNCC2)C[C@@H]1C(=O)NCCc1cccc2ccccc12
InChIInChI=1S/C22H29N3O/c1-25-16-22(10-13-23-14-11-22)15-20(25)21(26)24-12-9-18-7-4-6-17-5-2-3-8-19(17)18/h2-8,20,23H,9-16H2,1H3,(H,24,26)/t20-/m1/s1
InChIKeyZYWDCWJYZOILCU-HXUWFJFHSA-N
XLogP2.57
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.49
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(2-methoxyphenyl)propyl]-2-methyl-2,8-diazaspiro[4.5]decane-3-carboxamide
CID 56892746
N-[2-(2-chlorophenoxy)ethyl]-2-methyl-2,8-diazaspiro[4.5]decane-3-carboxamide;dihydrochloride
CID 154894652
(3R)-2-methyl-N-[2-(3-pyridin-3-yl-1H-1,2,4-triazol-5-yl)ethyl]-2,8-diazaspiro[4.5]decane-3-carboxamide
CID 95888750
(3R)-N-[[3-(difluoromethoxy)phenyl]methyl]-2-methyl-2,8-diazaspiro[4.5]decane-3-carboxamide
CID 95873096
(3R)-N-[3-(2-amino-1,3-thiazol-4-yl)propyl]-2-methyl-2,8-diazaspiro[4.5]decane-3-carboxamide
CID 95862437
N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-2-methyl-2,8-diazaspiro[4.5]decane-3-carboxamide
CID 56882354
N-(2-naphthalen-1-ylethyl)piperidine-2-carboxamide;hydrochloride
CID 119288851
N-(2-naphthalen-1-ylethyl)cyclohexanecarboxamide
CID 19963481
N-(2-naphthalen-1-ylethyl)-3-piperidin-4-ylbutanamide;hydrochloride
CID 119722521
(3R)-N-[1-(4-fluorophenyl)-2-methylpropan-2-yl]-2-methyl-2,8-diazaspiro[4.5]decane-3-carboxamide
CID 95891913
2-hydroxy-N-(2-naphthalen-1-ylethyl)propanamide
CID 115140997
N-(2-naphthalen-1-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119288849

Frequently Asked Questions

What is the IUPAC name of (3R)-2-methyl-N-(2-naphthalen-1-ylethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide?
The IUPAC name of (3R)-2-methyl-N-(2-naphthalen-1-ylethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide (CID 95863233) is (3R)-2-methyl-N-(2-naphthalen-1-ylethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide.
What is the SMILES notation for (3R)-2-methyl-N-(2-naphthalen-1-ylethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide?
The canonical SMILES for (3R)-2-methyl-N-(2-naphthalen-1-ylethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide is CN1CC2(CCNCC2)C[C@@H]1C(=O)NCCc1cccc2ccccc12.
What is the InChIKey of (3R)-2-methyl-N-(2-naphthalen-1-ylethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide?
The InChIKey is ZYWDCWJYZOILCU-HXUWFJFHSA-N. The full InChI is InChI=1S/C22H29N3O/c1-25-16-22(10-13-23-14-11-22)15-20(25)21(26)24-12-9-18-7-4-6-17-5-2-3-8-19(17)18/h2-8,20,23H,9-16H2,1H3,(H,24,26)/t20-/m1/s1.
What are the key properties of (3R)-2-methyl-N-(2-naphthalen-1-ylethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide?
(3R)-2-methyl-N-(2-naphthalen-1-ylethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide has a molecular weight of 351.49 g/mol, XLogP of 2.57, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-2-methyl-N-(2-naphthalen-1-ylethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide is sourced from PubChem (CID 95863233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).