N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-piperidin-4-yloxypropanamide

C14H29N3O3 — CID 106148337

IUPACN-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-piperidin-4-yloxypropanamide
SMILESCN(C)CC(C)(O)CNC(=O)CCOC1CCNCC1
InChIInChI=1S/C14H29N3O3/c1-14(19,11-17(2)3)10-16-13(18)6-9-20-12-4-7-15-8-5-12/h12,15,19H,4-11H2,1-3H3,(H,16,18)
InChIKeySHJMYAZTFNBJOB-UHFFFAOYSA-N
MW287.40 g/mol
LogP-0.43
Rot. Bonds8

About N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-piperidin-4-yloxypropanamide

N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-piperidin-4-yloxypropanamide (PubChem CID 106148337) has the molecular formula C14H29N3O3 and a molecular weight of 287.40 g/mol. Its IUPAC name is N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-piperidin-4-yloxypropanamide.

Molecular Properties

Compound NameN-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-piperidin-4-yloxypropanamide
PubChem CID106148337
Molecular FormulaC14H29N3O3
Molecular Weight287.40 g/mol
Exact Mass287.22
IUPAC NameN-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-piperidin-4-yloxypropanamide
SMILESCN(C)CC(C)(O)CNC(=O)CCOC1CCNCC1
InChIInChI=1S/C14H29N3O3/c1-14(19,11-17(2)3)10-16-13(18)6-9-20-12-4-7-15-8-5-12/h12,15,19H,4-11H2,1-3H3,(H,16,18)
InChIKeySHJMYAZTFNBJOB-UHFFFAOYSA-N
XLogP-0.43
TPSA73.83 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.40
LogP ≤ 5-0.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-piperidin-4-yloxypropanamide?
The IUPAC name of N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-piperidin-4-yloxypropanamide (CID 106148337) is N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-piperidin-4-yloxypropanamide.
What is the SMILES notation for N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-piperidin-4-yloxypropanamide?
The canonical SMILES for N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-piperidin-4-yloxypropanamide is CN(C)CC(C)(O)CNC(=O)CCOC1CCNCC1.
What is the InChIKey of N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-piperidin-4-yloxypropanamide?
The InChIKey is SHJMYAZTFNBJOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O3/c1-14(19,11-17(2)3)10-16-13(18)6-9-20-12-4-7-15-8-5-12/h12,15,19H,4-11H2,1-3H3,(H,16,18).
What are the key properties of N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-piperidin-4-yloxypropanamide?
N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-piperidin-4-yloxypropanamide has a molecular weight of 287.40 g/mol, XLogP of -0.43, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-piperidin-4-yloxypropanamide is sourced from PubChem (CID 106148337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).