N-(3-methylbutan-2-yl)-2-[piperidin-4-ylmethyl(propan-2-yl)amino]acetamide

C16H33N3O — CID 79714649

IUPACN-(3-methylbutan-2-yl)-2-[piperidin-4-ylmethyl(propan-2-yl)amino]acetamide
SMILESCC(C)C(C)NC(=O)CN(CC1CCNCC1)C(C)C
InChIInChI=1S/C16H33N3O/c1-12(2)14(5)18-16(20)11-19(13(3)4)10-15-6-8-17-9-7-15/h12-15,17H,6-11H2,1-5H3,(H,18,20)
InChIKeyAZQUELKHBZFJHR-UHFFFAOYSA-N
MW283.46 g/mol
LogP1.86
Rot. Bonds7

About N-(3-methylbutan-2-yl)-2-[piperidin-4-ylmethyl(propan-2-yl)amino]acetamide

N-(3-methylbutan-2-yl)-2-[piperidin-4-ylmethyl(propan-2-yl)amino]acetamide (PubChem CID 79714649) has the molecular formula C16H33N3O and a molecular weight of 283.46 g/mol. Its IUPAC name is N-(3-methylbutan-2-yl)-2-[piperidin-4-ylmethyl(propan-2-yl)amino]acetamide.

Molecular Properties

Compound NameN-(3-methylbutan-2-yl)-2-[piperidin-4-ylmethyl(propan-2-yl)amino]acetamide
PubChem CID79714649
Molecular FormulaC16H33N3O
Molecular Weight283.46 g/mol
Exact Mass283.26
IUPAC NameN-(3-methylbutan-2-yl)-2-[piperidin-4-ylmethyl(propan-2-yl)amino]acetamide
SMILESCC(C)C(C)NC(=O)CN(CC1CCNCC1)C(C)C
InChIInChI=1S/C16H33N3O/c1-12(2)14(5)18-16(20)11-19(13(3)4)10-15-6-8-17-9-7-15/h12-15,17H,6-11H2,1-5H3,(H,18,20)
InChIKeyAZQUELKHBZFJHR-UHFFFAOYSA-N
XLogP1.86
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.46
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[piperidin-4-ylmethyl(propan-2-yl)amino]-N-(propylcarbamoyl)acetamide
CID 79704024
N-methyl-4-[piperidin-4-ylmethyl(propan-2-yl)amino]butanamide
CID 79714818
2-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylprop-2-en-1-amine
CID 79713998
2-[azepan-4-yl(methyl)amino]-N-(3-methylbutan-2-yl)acetamide
CID 104979554
N-pentan-3-yl-2-[piperidin-3-ylmethyl(propan-2-yl)amino]acetamide
CID 106637889
2-[cyclopropylmethyl-[2-(3-methylbutan-2-ylamino)-2-oxoethyl]amino]acetic acid
CID 43656855
N-(3-methylbutan-2-yl)-2-[piperidin-4-yl(2,2,2-trifluoroethyl)amino]acetamide
CID 64851600
(2R)-1-[piperidin-4-ylmethyl(propan-2-yl)amino]propan-2-ol
CID 106933609
2-[2-hydroxyethyl(propan-2-yl)amino]-N-(3-methylbutan-2-yl)acetamide
CID 60691834
2-[2-aminoethyl(propan-2-yl)amino]-N-(3-methylbutan-2-yl)acetamide
CID 61489563
2-[cyclopropylmethyl(propan-2-yl)amino]-N-prop-2-ynylacetamide
CID 112731200
N-(3-methylbutan-2-yl)-2-piperidin-4-yloxyacetamide
CID 61489309

Frequently Asked Questions

What is the IUPAC name of N-(3-methylbutan-2-yl)-2-[piperidin-4-ylmethyl(propan-2-yl)amino]acetamide?
The IUPAC name of N-(3-methylbutan-2-yl)-2-[piperidin-4-ylmethyl(propan-2-yl)amino]acetamide (CID 79714649) is N-(3-methylbutan-2-yl)-2-[piperidin-4-ylmethyl(propan-2-yl)amino]acetamide.
What is the SMILES notation for N-(3-methylbutan-2-yl)-2-[piperidin-4-ylmethyl(propan-2-yl)amino]acetamide?
The canonical SMILES for N-(3-methylbutan-2-yl)-2-[piperidin-4-ylmethyl(propan-2-yl)amino]acetamide is CC(C)C(C)NC(=O)CN(CC1CCNCC1)C(C)C.
What is the InChIKey of N-(3-methylbutan-2-yl)-2-[piperidin-4-ylmethyl(propan-2-yl)amino]acetamide?
The InChIKey is AZQUELKHBZFJHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N3O/c1-12(2)14(5)18-16(20)11-19(13(3)4)10-15-6-8-17-9-7-15/h12-15,17H,6-11H2,1-5H3,(H,18,20).
What are the key properties of N-(3-methylbutan-2-yl)-2-[piperidin-4-ylmethyl(propan-2-yl)amino]acetamide?
N-(3-methylbutan-2-yl)-2-[piperidin-4-ylmethyl(propan-2-yl)amino]acetamide has a molecular weight of 283.46 g/mol, XLogP of 1.86, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylbutan-2-yl)-2-[piperidin-4-ylmethyl(propan-2-yl)amino]acetamide is sourced from PubChem (CID 79714649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).