N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-(2,5-dimethylpyrrolidin-1-yl)propanamide

C15H31N3O2 — CID 71910887

IUPACN-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-(2,5-dimethylpyrrolidin-1-yl)propanamide
SMILESCC1CCC(C)N1C(C)C(=O)NCC(C)(O)CN(C)C
InChIInChI=1S/C15H31N3O2/c1-11-7-8-12(2)18(11)13(3)14(19)16-9-15(4,20)10-17(5)6/h11-13,20H,7-10H2,1-6H3,(H,16,19)
InChIKeyHQQGTCRYFWFNNO-UHFFFAOYSA-N
MW285.43 g/mol
LogP0.68
Rot. Bonds6

About N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-(2,5-dimethylpyrrolidin-1-yl)propanamide

N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-(2,5-dimethylpyrrolidin-1-yl)propanamide (PubChem CID 71910887) has the molecular formula C15H31N3O2 and a molecular weight of 285.43 g/mol. Its IUPAC name is N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-(2,5-dimethylpyrrolidin-1-yl)propanamide.

Molecular Properties

Compound NameN-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-(2,5-dimethylpyrrolidin-1-yl)propanamide
PubChem CID71910887
Molecular FormulaC15H31N3O2
Molecular Weight285.43 g/mol
Exact Mass285.24
IUPAC NameN-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-(2,5-dimethylpyrrolidin-1-yl)propanamide
SMILESCC1CCC(C)N1C(C)C(=O)NCC(C)(O)CN(C)C
InChIInChI=1S/C15H31N3O2/c1-11-7-8-12(2)18(11)13(3)14(19)16-9-15(4,20)10-17(5)6/h11-13,20H,7-10H2,1-6H3,(H,16,19)
InChIKeyHQQGTCRYFWFNNO-UHFFFAOYSA-N
XLogP0.68
TPSA55.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.43
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-4,4-difluorocyclohexane-1-carboxamide
CID 103860797
N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]cyclooctanecarboxamide
CID 103840050
2-acetamido-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-methylbutanamide
CID 103839615
N-(2-amino-2-cyclopropylethyl)-2-(2,5-dimethylpyrrolidin-1-yl)propanamide
CID 113282148
3-amino-3-cyclopropyl-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]propanamide
CID 114150174
N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3,4,4-trimethylpentanamide
CID 113322168
2-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-phenylacetamide
CID 106148425
ethyl 2-amino-3-[[3-(dimethylamino)-2-hydroxy-2-methylpropyl]amino]-3-oxopropanoate
CID 106148353
N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-(methanesulfonamido)-4-methylpentanamide
CID 103840129
N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-propan-2-yloxyacetamide
CID 103840231
N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-methylpentanamide
CID 103525819
2-bromo-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-methylpropanamide
CID 106146098

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-(2,5-dimethylpyrrolidin-1-yl)propanamide?
The IUPAC name of N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-(2,5-dimethylpyrrolidin-1-yl)propanamide (CID 71910887) is N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-(2,5-dimethylpyrrolidin-1-yl)propanamide.
What is the SMILES notation for N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-(2,5-dimethylpyrrolidin-1-yl)propanamide?
The canonical SMILES for N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-(2,5-dimethylpyrrolidin-1-yl)propanamide is CC1CCC(C)N1C(C)C(=O)NCC(C)(O)CN(C)C.
What is the InChIKey of N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-(2,5-dimethylpyrrolidin-1-yl)propanamide?
The InChIKey is HQQGTCRYFWFNNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O2/c1-11-7-8-12(2)18(11)13(3)14(19)16-9-15(4,20)10-17(5)6/h11-13,20H,7-10H2,1-6H3,(H,16,19).
What are the key properties of N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-(2,5-dimethylpyrrolidin-1-yl)propanamide?
N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-(2,5-dimethylpyrrolidin-1-yl)propanamide has a molecular weight of 285.43 g/mol, XLogP of 0.68, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-(2,5-dimethylpyrrolidin-1-yl)propanamide is sourced from PubChem (CID 71910887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).