(3R)-N,2-dimethyl-N-(2-phenylethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide

C19H29N3O — CID 95874258

IUPAC(3R)-N,2-dimethyl-N-(2-phenylethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide
SMILESCN(CCc1ccccc1)C(=O)[C@H]1CC2(CCNCC2)CN1C
InChIInChI=1S/C19H29N3O/c1-21(13-8-16-6-4-3-5-7-16)18(23)17-14-19(15-22(17)2)9-11-20-12-10-19/h3-7,17,20H,8-15H2,1-2H3/t17-/m1/s1
InChIKeyYDOWFBYXWTVMSJ-QGZVFWFLSA-N
MW315.46 g/mol
LogP1.76
Rot. Bonds4

About (3R)-N,2-dimethyl-N-(2-phenylethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide

(3R)-N,2-dimethyl-N-(2-phenylethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide (PubChem CID 95874258) has the molecular formula C19H29N3O and a molecular weight of 315.46 g/mol. Its IUPAC name is (3R)-N,2-dimethyl-N-(2-phenylethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide.

Molecular Properties

Compound Name(3R)-N,2-dimethyl-N-(2-phenylethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide
PubChem CID95874258
Molecular FormulaC19H29N3O
Molecular Weight315.46 g/mol
Exact Mass315.23
IUPAC Name(3R)-N,2-dimethyl-N-(2-phenylethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide
SMILESCN(CCc1ccccc1)C(=O)[C@H]1CC2(CCNCC2)CN1C
InChIInChI=1S/C19H29N3O/c1-21(13-8-16-6-4-3-5-7-16)18(23)17-14-19(15-22(17)2)9-11-20-12-10-19/h3-7,17,20H,8-15H2,1-2H3/t17-/m1/s1
InChIKeyYDOWFBYXWTVMSJ-QGZVFWFLSA-N
XLogP1.76
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.46
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3R)-N,2-dimethyl-N-(2-phenylethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide?
The IUPAC name of (3R)-N,2-dimethyl-N-(2-phenylethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide (CID 95874258) is (3R)-N,2-dimethyl-N-(2-phenylethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide.
What is the SMILES notation for (3R)-N,2-dimethyl-N-(2-phenylethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide?
The canonical SMILES for (3R)-N,2-dimethyl-N-(2-phenylethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide is CN(CCc1ccccc1)C(=O)[C@H]1CC2(CCNCC2)CN1C.
What is the InChIKey of (3R)-N,2-dimethyl-N-(2-phenylethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide?
The InChIKey is YDOWFBYXWTVMSJ-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H29N3O/c1-21(13-8-16-6-4-3-5-7-16)18(23)17-14-19(15-22(17)2)9-11-20-12-10-19/h3-7,17,20H,8-15H2,1-2H3/t17-/m1/s1.
What are the key properties of (3R)-N,2-dimethyl-N-(2-phenylethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide?
(3R)-N,2-dimethyl-N-(2-phenylethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide has a molecular weight of 315.46 g/mol, XLogP of 1.76, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N,2-dimethyl-N-(2-phenylethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide is sourced from PubChem (CID 95874258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).