(3R)-N,8-dimethyl-N-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl]-2-propyl-2,8-diazaspiro[4.5]decane-3-carboxamide

C20H35N5O2 — CID 95870218

About (3R)-N,8-dimethyl-N-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl]-2-propyl-2,8-diazaspiro[4.5]decane-3-carboxamide

(3R)-N,8-dimethyl-N-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl]-2-propyl-2,8-diazaspiro[4.5]decane-3-carboxamide (PubChem CID 95870218) has the molecular formula C20H35N5O2 and a molecular weight of 377.53 g/mol. Its IUPAC name is (3R)-N,8-dimethyl-N-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl]-2-propyl-2,8-diazaspiro[4.5]decane-3-carboxamide.

Molecular Properties

• Compound Name: (3R)-N,8-dimethyl-N-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl]-2-propyl-2,8-diazaspiro[4.5]decane-3-carboxamide
• PubChem CID: 95870218
• Molecular Formula: C20H35N5O2
• Molecular Weight: 377.53 g/mol
• Exact Mass: 377.28
• IUPAC Name: (3R)-N,8-dimethyl-N-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl]-2-propyl-2,8-diazaspiro[4.5]decane-3-carboxamide
• SMILES: CCCN1CC2(CCN(C)CC2)C[C@@H]1C(=O)N(C)Cc1nc(C(C)C)no1
• InChI: InChI=1S/C20H35N5O2/c1-6-9-25-14-20(7-10-23(4)11-8-20)12-16(25)19(26)24(5)13-17-21-18(15(2)3)22-27-17/h15-16H,6-14H2,1-5H3/t16-/m1/s1
• InChIKey: YSFGMARDRLQPHG-MRXNPFEDSA-N
• XLogP: 2.35
• TPSA: 65.71 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 6
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	377.53
LogP ≤ 5	2.35
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of (3R)-N,8-dimethyl-N-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl]-2-propyl-2,8-diazaspiro[4.5]decane-3-carboxamide?

The IUPAC name of (3R)-N,8-dimethyl-N-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl]-2-propyl-2,8-diazaspiro[4.5]decane-3-carboxamide (CID 95870218) is (3R)-N,8-dimethyl-N-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl]-2-propyl-2,8-diazaspiro[4.5]decane-3-carboxamide.

What is the SMILES notation for (3R)-N,8-dimethyl-N-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl]-2-propyl-2,8-diazaspiro[4.5]decane-3-carboxamide?

The canonical SMILES for (3R)-N,8-dimethyl-N-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl]-2-propyl-2,8-diazaspiro[4.5]decane-3-carboxamide is CCCN1CC2(CCN(C)CC2)C[C@@H]1C(=O)N(C)Cc1nc(C(C)C)no1.

What is the InChIKey of (3R)-N,8-dimethyl-N-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl]-2-propyl-2,8-diazaspiro[4.5]decane-3-carboxamide?

The InChIKey is YSFGMARDRLQPHG-MRXNPFEDSA-N. The full InChI is InChI=1S/C20H35N5O2/c1-6-9-25-14-20(7-10-23(4)11-8-20)12-16(25)19(26)24(5)13-17-21-18(15(2)3)22-27-17/h15-16H,6-14H2,1-5H3/t16-/m1/s1.

What are the key properties of (3R)-N,8-dimethyl-N-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl]-2-propyl-2,8-diazaspiro[4.5]decane-3-carboxamide?

(3R)-N,8-dimethyl-N-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl]-2-propyl-2,8-diazaspiro[4.5]decane-3-carboxamide has a molecular weight of 377.53 g/mol, XLogP of 2.35, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for (3R)-N,8-dimethyl-N-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl]-2-propyl-2,8-diazaspiro[4.5]decane-3-carboxamide is sourced from PubChem (CID 95870218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).