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

C12H26N2O2 — CID 103525819

IUPACN-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-methylpentanamide
SMILESCCC(C)CC(=O)NCC(C)(O)CN(C)C
InChIInChI=1S/C12H26N2O2/c1-6-10(2)7-11(15)13-8-12(3,16)9-14(4)5/h10,16H,6-9H2,1-5H3,(H,13,15)
InChIKeyZIKVAGUYKOVBPJ-UHFFFAOYSA-N
MW230.35 g/mol
LogP0.85
Rot. Bonds7

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

N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-methylpentanamide (PubChem CID 103525819) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-methylpentanamide.

Molecular Properties

Compound NameN-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-methylpentanamide
PubChem CID103525819
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC NameN-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-methylpentanamide
SMILESCCC(C)CC(=O)NCC(C)(O)CN(C)C
InChIInChI=1S/C12H26N2O2/c1-6-10(2)7-11(15)13-8-12(3,16)9-14(4)5/h10,16H,6-9H2,1-5H3,(H,13,15)
InChIKeyZIKVAGUYKOVBPJ-UHFFFAOYSA-N
XLogP0.85
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3,4,4-trimethylpentanamide
CID 113322168
N-(2,3-dihydroxy-2-methylpropyl)-3-methylpentanamide
CID 114875437
N-(2-hydroxy-2-methyl-3-methylsulfanylpropyl)-3-methylpentanamide
CID 103522092
5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-4-methylpentanamide
CID 106148529
N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-propan-2-yloxyacetamide
CID 103840231
N-(2-ethyl-2-hydroxybutyl)-3-methylpentanamide
CID 114875415
3-amino-3-cyclopropyl-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]propanamide
CID 114150174
5-[(2-hydroxy-2-methylbutyl)amino]-3-methyl-5-oxopentanoic acid
CID 65108474
ethyl 4-[[3-(dimethylamino)-2-hydroxy-2-methylpropyl]amino]-4-oxobutanoate
CID 103839873
5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]pentanamide
CID 106148441
N-(2-hydroxypropyl)-3-methylpentanamide
CID 114875363
N-[(2S)-2-hydroxypropyl]-3-methylpentanamide
CID 104982256

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-methylpentanamide?
The IUPAC name of N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-methylpentanamide (CID 103525819) is N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-methylpentanamide.
What is the SMILES notation for N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-methylpentanamide?
The canonical SMILES for N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-methylpentanamide is CCC(C)CC(=O)NCC(C)(O)CN(C)C.
What is the InChIKey of N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-methylpentanamide?
The InChIKey is ZIKVAGUYKOVBPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-6-10(2)7-11(15)13-8-12(3,16)9-14(4)5/h10,16H,6-9H2,1-5H3,(H,13,15).
What are the key properties of N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-methylpentanamide?
N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-methylpentanamide has a molecular weight of 230.35 g/mol, XLogP of 0.85, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-methylpentanamide is sourced from PubChem (CID 103525819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).