3-[(2,2-dimethylpiperidin-4-yl)amino]-2,2-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide

C21H42N4O — CID 142680807

IUPAC3-[(2,2-dimethylpiperidin-4-yl)amino]-2,2-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide
SMILESCC1(C)CC(NCC(C)(C)C(=O)NC2CC(C)(C)NC(C)(C)C2)CCN1
InChIInChI=1S/C21H42N4O/c1-18(2,14-22-15-9-10-23-19(3,4)11-15)17(26)24-16-12-20(5,6)25-21(7,8)13-16/h15-16,22-23,25H,9-14H2,1-8H3,(H,24,26)
InChIKeyKCWHGYVURSJVQV-UHFFFAOYSA-N
MW366.59 g/mol
LogP2.56
Rot. Bonds5

About 3-[(2,2-dimethylpiperidin-4-yl)amino]-2,2-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide

3-[(2,2-dimethylpiperidin-4-yl)amino]-2,2-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide (PubChem CID 142680807) has the molecular formula C21H42N4O and a molecular weight of 366.59 g/mol. Its IUPAC name is 3-[(2,2-dimethylpiperidin-4-yl)amino]-2,2-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide.

Molecular Properties

Compound Name3-[(2,2-dimethylpiperidin-4-yl)amino]-2,2-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide
PubChem CID142680807
Molecular FormulaC21H42N4O
Molecular Weight366.59 g/mol
Exact Mass366.34
IUPAC Name3-[(2,2-dimethylpiperidin-4-yl)amino]-2,2-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide
SMILESCC1(C)CC(NCC(C)(C)C(=O)NC2CC(C)(C)NC(C)(C)C2)CCN1
InChIInChI=1S/C21H42N4O/c1-18(2,14-22-15-9-10-23-19(3,4)11-15)17(26)24-16-12-20(5,6)25-21(7,8)13-16/h15-16,22-23,25H,9-14H2,1-8H3,(H,24,26)
InChIKeyKCWHGYVURSJVQV-UHFFFAOYSA-N
XLogP2.56
TPSA65.19 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.59
LogP ≤ 52.56
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[(2,2-dimethylpiperidin-4-yl)amino]-2,2-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide?
The IUPAC name of 3-[(2,2-dimethylpiperidin-4-yl)amino]-2,2-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide (CID 142680807) is 3-[(2,2-dimethylpiperidin-4-yl)amino]-2,2-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide.
What is the SMILES notation for 3-[(2,2-dimethylpiperidin-4-yl)amino]-2,2-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide?
The canonical SMILES for 3-[(2,2-dimethylpiperidin-4-yl)amino]-2,2-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide is CC1(C)CC(NCC(C)(C)C(=O)NC2CC(C)(C)NC(C)(C)C2)CCN1.
What is the InChIKey of 3-[(2,2-dimethylpiperidin-4-yl)amino]-2,2-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide?
The InChIKey is KCWHGYVURSJVQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H42N4O/c1-18(2,14-22-15-9-10-23-19(3,4)11-15)17(26)24-16-12-20(5,6)25-21(7,8)13-16/h15-16,22-23,25H,9-14H2,1-8H3,(H,24,26).
What are the key properties of 3-[(2,2-dimethylpiperidin-4-yl)amino]-2,2-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide?
3-[(2,2-dimethylpiperidin-4-yl)amino]-2,2-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide has a molecular weight of 366.59 g/mol, XLogP of 2.56, 5 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2,2-dimethylpiperidin-4-yl)amino]-2,2-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide is sourced from PubChem (CID 142680807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).