N-[1-[(4-amino-2-methylbutan-2-yl)amino]-2-methylpropan-2-yl]-2,2,5,5-tetramethylhexanamide

C19H41N3O — CID 143529197

IUPACN-[1-[(4-amino-2-methylbutan-2-yl)amino]-2-methylpropan-2-yl]-2,2,5,5-tetramethylhexanamide
SMILESCC(C)(C)CCC(C)(C)C(=O)NC(C)(C)CNC(C)(C)CCN
InChIInChI=1S/C19H41N3O/c1-16(2,3)10-11-17(4,5)15(23)22-19(8,9)14-21-18(6,7)12-13-20/h21H,10-14,20H2,1-9H3,(H,22,23)
InChIKeyXJAQDAFNRZHGHH-UHFFFAOYSA-N
MW327.56 g/mol
LogP3.45
Rot. Bonds9

About N-[1-[(4-amino-2-methylbutan-2-yl)amino]-2-methylpropan-2-yl]-2,2,5,5-tetramethylhexanamide

N-[1-[(4-amino-2-methylbutan-2-yl)amino]-2-methylpropan-2-yl]-2,2,5,5-tetramethylhexanamide (PubChem CID 143529197) has the molecular formula C19H41N3O and a molecular weight of 327.56 g/mol. Its IUPAC name is N-[1-[(4-amino-2-methylbutan-2-yl)amino]-2-methylpropan-2-yl]-2,2,5,5-tetramethylhexanamide.

Molecular Properties

Compound NameN-[1-[(4-amino-2-methylbutan-2-yl)amino]-2-methylpropan-2-yl]-2,2,5,5-tetramethylhexanamide
PubChem CID143529197
Molecular FormulaC19H41N3O
Molecular Weight327.56 g/mol
Exact Mass327.32
IUPAC NameN-[1-[(4-amino-2-methylbutan-2-yl)amino]-2-methylpropan-2-yl]-2,2,5,5-tetramethylhexanamide
SMILESCC(C)(C)CCC(C)(C)C(=O)NC(C)(C)CNC(C)(C)CCN
InChIInChI=1S/C19H41N3O/c1-16(2,3)10-11-17(4,5)15(23)22-19(8,9)14-21-18(6,7)12-13-20/h21H,10-14,20H2,1-9H3,(H,22,23)
InChIKeyXJAQDAFNRZHGHH-UHFFFAOYSA-N
XLogP3.45
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.56
LogP ≤ 53.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-[(4-amino-2-methylbutan-2-yl)amino]-2-methylpropan-2-yl]-2,2,5,5-tetramethylhexanamide?
The IUPAC name of N-[1-[(4-amino-2-methylbutan-2-yl)amino]-2-methylpropan-2-yl]-2,2,5,5-tetramethylhexanamide (CID 143529197) is N-[1-[(4-amino-2-methylbutan-2-yl)amino]-2-methylpropan-2-yl]-2,2,5,5-tetramethylhexanamide.
What is the SMILES notation for N-[1-[(4-amino-2-methylbutan-2-yl)amino]-2-methylpropan-2-yl]-2,2,5,5-tetramethylhexanamide?
The canonical SMILES for N-[1-[(4-amino-2-methylbutan-2-yl)amino]-2-methylpropan-2-yl]-2,2,5,5-tetramethylhexanamide is CC(C)(C)CCC(C)(C)C(=O)NC(C)(C)CNC(C)(C)CCN.
What is the InChIKey of N-[1-[(4-amino-2-methylbutan-2-yl)amino]-2-methylpropan-2-yl]-2,2,5,5-tetramethylhexanamide?
The InChIKey is XJAQDAFNRZHGHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H41N3O/c1-16(2,3)10-11-17(4,5)15(23)22-19(8,9)14-21-18(6,7)12-13-20/h21H,10-14,20H2,1-9H3,(H,22,23).
What are the key properties of N-[1-[(4-amino-2-methylbutan-2-yl)amino]-2-methylpropan-2-yl]-2,2,5,5-tetramethylhexanamide?
N-[1-[(4-amino-2-methylbutan-2-yl)amino]-2-methylpropan-2-yl]-2,2,5,5-tetramethylhexanamide has a molecular weight of 327.56 g/mol, XLogP of 3.45, 9 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(4-amino-2-methylbutan-2-yl)amino]-2-methylpropan-2-yl]-2,2,5,5-tetramethylhexanamide is sourced from PubChem (CID 143529197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).