N-tert-butyl-2-[[2-(dimethylamino)-2-methylpropyl]amino]propanamide

C13H29N3O — CID 54940320

IUPACN-tert-butyl-2-[[2-(dimethylamino)-2-methylpropyl]amino]propanamide
SMILESCC(NCC(C)(C)N(C)C)C(=O)NC(C)(C)C
InChIInChI=1S/C13H29N3O/c1-10(11(17)15-12(2,3)4)14-9-13(5,6)16(7)8/h10,14H,9H2,1-8H3,(H,15,17)
InChIKeyQYTCWIXLZSOWOG-UHFFFAOYSA-N
MW243.39 g/mol
LogP1.22
Rot. Bonds5

About N-tert-butyl-2-[[2-(dimethylamino)-2-methylpropyl]amino]propanamide

N-tert-butyl-2-[[2-(dimethylamino)-2-methylpropyl]amino]propanamide (PubChem CID 54940320) has the molecular formula C13H29N3O and a molecular weight of 243.39 g/mol. Its IUPAC name is N-tert-butyl-2-[[2-(dimethylamino)-2-methylpropyl]amino]propanamide.

Molecular Properties

Compound NameN-tert-butyl-2-[[2-(dimethylamino)-2-methylpropyl]amino]propanamide
PubChem CID54940320
Molecular FormulaC13H29N3O
Molecular Weight243.39 g/mol
Exact Mass243.23
IUPAC NameN-tert-butyl-2-[[2-(dimethylamino)-2-methylpropyl]amino]propanamide
SMILESCC(NCC(C)(C)N(C)C)C(=O)NC(C)(C)C
InChIInChI=1S/C13H29N3O/c1-10(11(17)15-12(2,3)4)14-9-13(5,6)16(7)8/h10,14H,9H2,1-8H3,(H,15,17)
InChIKeyQYTCWIXLZSOWOG-UHFFFAOYSA-N
XLogP1.22
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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N-[2-(dimethylamino)-2-methylpropyl]-2-sulfanylpropanamide
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2-(3-aminopropylamino)-N-tert-butylpropanamide
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N-tert-butyl-2-(2-methylsulfanylethylamino)propanamide
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(2S)-2-amino-N-[2-(dimethylamino)-2-methylpropyl]propanamide
CID 61249640
N-tert-butyl-2-[(2,2,3,3-tetramethylcyclopropyl)methylamino]propanamide
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Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-[[2-(dimethylamino)-2-methylpropyl]amino]propanamide?
The IUPAC name of N-tert-butyl-2-[[2-(dimethylamino)-2-methylpropyl]amino]propanamide (CID 54940320) is N-tert-butyl-2-[[2-(dimethylamino)-2-methylpropyl]amino]propanamide.
What is the SMILES notation for N-tert-butyl-2-[[2-(dimethylamino)-2-methylpropyl]amino]propanamide?
The canonical SMILES for N-tert-butyl-2-[[2-(dimethylamino)-2-methylpropyl]amino]propanamide is CC(NCC(C)(C)N(C)C)C(=O)NC(C)(C)C.
What is the InChIKey of N-tert-butyl-2-[[2-(dimethylamino)-2-methylpropyl]amino]propanamide?
The InChIKey is QYTCWIXLZSOWOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29N3O/c1-10(11(17)15-12(2,3)4)14-9-13(5,6)16(7)8/h10,14H,9H2,1-8H3,(H,15,17).
What are the key properties of N-tert-butyl-2-[[2-(dimethylamino)-2-methylpropyl]amino]propanamide?
N-tert-butyl-2-[[2-(dimethylamino)-2-methylpropyl]amino]propanamide has a molecular weight of 243.39 g/mol, XLogP of 1.22, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-[[2-(dimethylamino)-2-methylpropyl]amino]propanamide is sourced from PubChem (CID 54940320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).