5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-4-methylpentanamide

C12H27N3O2 — CID 106148529

IUPAC5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-4-methylpentanamide
SMILESCC(CN)CCC(=O)NCC(C)(O)CN(C)C
InChIInChI=1S/C12H27N3O2/c1-10(7-13)5-6-11(16)14-8-12(2,17)9-15(3)4/h10,17H,5-9,13H2,1-4H3,(H,14,16)
InChIKeyZNSBFBKSAPTGSW-UHFFFAOYSA-N
MW245.37 g/mol
LogP-0.21
Rot. Bonds8

About 5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-4-methylpentanamide

5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-4-methylpentanamide (PubChem CID 106148529) has the molecular formula C12H27N3O2 and a molecular weight of 245.37 g/mol. Its IUPAC name is 5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-4-methylpentanamide.

Molecular Properties

Compound Name5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-4-methylpentanamide
PubChem CID106148529
Molecular FormulaC12H27N3O2
Molecular Weight245.37 g/mol
Exact Mass245.21
IUPAC Name5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-4-methylpentanamide
SMILESCC(CN)CCC(=O)NCC(C)(O)CN(C)C
InChIInChI=1S/C12H27N3O2/c1-10(7-13)5-6-11(16)14-8-12(2,17)9-15(3)4/h10,17H,5-9,13H2,1-4H3,(H,14,16)
InChIKeyZNSBFBKSAPTGSW-UHFFFAOYSA-N
XLogP-0.21
TPSA78.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 5-0.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]pentanamide
CID 106148441
N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-methylpentanamide
CID 103525819
ethyl 4-[[3-(dimethylamino)-2-hydroxy-2-methylpropyl]amino]-4-oxobutanoate
CID 103839873
N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3,4,4-trimethylpentanamide
CID 113322168
N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-propan-2-yloxyacetamide
CID 103840231
1-(1-aminopropan-2-ylamino)-3-(dimethylamino)-2-methylpropan-2-ol
CID 106145662
3-amino-3-cyclopropyl-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]propanamide
CID 114150174
4-cyclohexyl-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]butanamide
CID 103839791
5-amino-4-methyl-N-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]pentanamide
CID 82012149
4-[(4-amino-3-methylbutanoyl)amino]-3-hydroxy-3-methylbutanoic acid
CID 81079399
2-(4-aminophenyl)-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]acetamide
CID 106139459
5-amino-N-(2,3-dimethylbutyl)-4-methylpentanamide
CID 82688279

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-4-methylpentanamide?
The IUPAC name of 5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-4-methylpentanamide (CID 106148529) is 5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-4-methylpentanamide.
What is the SMILES notation for 5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-4-methylpentanamide?
The canonical SMILES for 5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-4-methylpentanamide is CC(CN)CCC(=O)NCC(C)(O)CN(C)C.
What is the InChIKey of 5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-4-methylpentanamide?
The InChIKey is ZNSBFBKSAPTGSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27N3O2/c1-10(7-13)5-6-11(16)14-8-12(2,17)9-15(3)4/h10,17H,5-9,13H2,1-4H3,(H,14,16).
What are the key properties of 5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-4-methylpentanamide?
5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-4-methylpentanamide has a molecular weight of 245.37 g/mol, XLogP of -0.21, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-4-methylpentanamide is sourced from PubChem (CID 106148529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).