1-N,3-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)naphthalene-1,3-dicarboxamide

C30H44N4O2 — CID 162717936

IUPAC1-N,3-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)naphthalene-1,3-dicarboxamide
SMILESCC1(C)CC(NC(=O)c2cc(C(=O)NC3CC(C)(C)NC(C)(C)C3)c3ccccc3c2)CC(C)(C)N1
InChIInChI=1S/C30H44N4O2/c1-27(2)15-21(16-28(3,4)33-27)31-25(35)20-13-19-11-9-10-12-23(19)24(14-20)26(36)32-22-17-29(5,6)34-30(7,8)18-22/h9-14,21-22,33-34H,15-18H2,1-8H3,(H,31,35)(H,32,36)
InChIKeyZMLQHPMTYMUNDA-UHFFFAOYSA-N
MW492.71 g/mol
LogP4.92
Rot. Bonds4

About 1-N,3-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)naphthalene-1,3-dicarboxamide

1-N,3-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)naphthalene-1,3-dicarboxamide (PubChem CID 162717936) has the molecular formula C30H44N4O2 and a molecular weight of 492.71 g/mol. Its IUPAC name is 1-N,3-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)naphthalene-1,3-dicarboxamide.

Molecular Properties

Compound Name1-N,3-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)naphthalene-1,3-dicarboxamide
PubChem CID162717936
Molecular FormulaC30H44N4O2
Molecular Weight492.71 g/mol
Exact Mass492.35
IUPAC Name1-N,3-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)naphthalene-1,3-dicarboxamide
SMILESCC1(C)CC(NC(=O)c2cc(C(=O)NC3CC(C)(C)NC(C)(C)C3)c3ccccc3c2)CC(C)(C)N1
InChIInChI=1S/C30H44N4O2/c1-27(2)15-21(16-28(3,4)33-27)31-25(35)20-13-19-11-9-10-12-23(19)24(14-20)26(36)32-22-17-29(5,6)34-30(7,8)18-22/h9-14,21-22,33-34H,15-18H2,1-8H3,(H,31,35)(H,32,36)
InChIKeyZMLQHPMTYMUNDA-UHFFFAOYSA-N
XLogP4.92
TPSA82.26 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500492.71
LogP ≤ 54.92
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-N,3-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)naphthalene-1,3-dicarboxamide?
The IUPAC name of 1-N,3-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)naphthalene-1,3-dicarboxamide (CID 162717936) is 1-N,3-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)naphthalene-1,3-dicarboxamide.
What is the SMILES notation for 1-N,3-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)naphthalene-1,3-dicarboxamide?
The canonical SMILES for 1-N,3-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)naphthalene-1,3-dicarboxamide is CC1(C)CC(NC(=O)c2cc(C(=O)NC3CC(C)(C)NC(C)(C)C3)c3ccccc3c2)CC(C)(C)N1.
What is the InChIKey of 1-N,3-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)naphthalene-1,3-dicarboxamide?
The InChIKey is ZMLQHPMTYMUNDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H44N4O2/c1-27(2)15-21(16-28(3,4)33-27)31-25(35)20-13-19-11-9-10-12-23(19)24(14-20)26(36)32-22-17-29(5,6)34-30(7,8)18-22/h9-14,21-22,33-34H,15-18H2,1-8H3,(H,31,35)(H,32,36).
What are the key properties of 1-N,3-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)naphthalene-1,3-dicarboxamide?
1-N,3-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)naphthalene-1,3-dicarboxamide has a molecular weight of 492.71 g/mol, XLogP of 4.92, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,3-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)naphthalene-1,3-dicarboxamide is sourced from PubChem (CID 162717936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).