2-amino-N-(1-tert-butylpiperidin-4-yl)-2-methylpropanamide

C13H27N3O — CID 61264639

IUPAC2-amino-N-(1-tert-butylpiperidin-4-yl)-2-methylpropanamide
SMILESCC(C)(N)C(=O)NC1CCN(C(C)(C)C)CC1
InChIInChI=1S/C13H27N3O/c1-12(2,3)16-8-6-10(7-9-16)15-11(17)13(4,5)14/h10H,6-9,14H2,1-5H3,(H,15,17)
InChIKeyTWVMVZCNVPZOQC-UHFFFAOYSA-N
MW241.38 g/mol
LogP1.10
Rot. Bonds2

About 2-amino-N-(1-tert-butylpiperidin-4-yl)-2-methylpropanamide

2-amino-N-(1-tert-butylpiperidin-4-yl)-2-methylpropanamide (PubChem CID 61264639) has the molecular formula C13H27N3O and a molecular weight of 241.38 g/mol. Its IUPAC name is 2-amino-N-(1-tert-butylpiperidin-4-yl)-2-methylpropanamide.

Molecular Properties

Compound Name2-amino-N-(1-tert-butylpiperidin-4-yl)-2-methylpropanamide
PubChem CID61264639
Molecular FormulaC13H27N3O
Molecular Weight241.38 g/mol
Exact Mass241.22
IUPAC Name2-amino-N-(1-tert-butylpiperidin-4-yl)-2-methylpropanamide
SMILESCC(C)(N)C(=O)NC1CCN(C(C)(C)C)CC1
InChIInChI=1S/C13H27N3O/c1-12(2,3)16-8-6-10(7-9-16)15-11(17)13(4,5)14/h10H,6-9,14H2,1-5H3,(H,15,17)
InChIKeyTWVMVZCNVPZOQC-UHFFFAOYSA-N
XLogP1.10
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(1-tert-butylpiperidin-4-yl)-3,3,3-trifluoro-2-methylpropanamide
CID 79805040
2-amino-N-(1-ethylpiperidin-4-yl)-2-methylpropanamide
CID 61266826
N-(1-tert-butylpiperidin-4-yl)-3-chloro-2,2-dimethylpropanamide
CID 63681125
1-amino-N-(1-tert-butylpiperidin-4-yl)cyclopropane-1-carboxamide
CID 65465095
2-amino-N-(4-aminocyclohexyl)-2-methylpropanamide
CID 62319991
2-amino-N-(1-cyclopropylpyrrolidin-3-yl)-2-methylpropanamide;dihydrochloride
CID 119864797
2-amino-N-[1-(2-methoxyacetyl)piperidin-4-yl]-2-methylpropanamide
CID 61266193
N-[(3R)-1-tert-butylpyrrolidin-3-yl]-2,2,2-trifluoroacetamide
CID 90438031
2-amino-2-methyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)propanamide
CID 61265591
2-amino-N-[1-(4-tert-butylphenyl)piperidin-4-yl]-2-methylpropanamide;dihydrochloride
CID 119862908
2-(aminomethyl)-N-(1-tert-butylpiperidin-4-yl)-3-methylbutanamide
CID 65230009
2-amino-N-(1-tert-butylpiperidin-4-yl)-3-methylpentanamide
CID 54863095

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1-tert-butylpiperidin-4-yl)-2-methylpropanamide?
The IUPAC name of 2-amino-N-(1-tert-butylpiperidin-4-yl)-2-methylpropanamide (CID 61264639) is 2-amino-N-(1-tert-butylpiperidin-4-yl)-2-methylpropanamide.
What is the SMILES notation for 2-amino-N-(1-tert-butylpiperidin-4-yl)-2-methylpropanamide?
The canonical SMILES for 2-amino-N-(1-tert-butylpiperidin-4-yl)-2-methylpropanamide is CC(C)(N)C(=O)NC1CCN(C(C)(C)C)CC1.
What is the InChIKey of 2-amino-N-(1-tert-butylpiperidin-4-yl)-2-methylpropanamide?
The InChIKey is TWVMVZCNVPZOQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O/c1-12(2,3)16-8-6-10(7-9-16)15-11(17)13(4,5)14/h10H,6-9,14H2,1-5H3,(H,15,17).
What are the key properties of 2-amino-N-(1-tert-butylpiperidin-4-yl)-2-methylpropanamide?
2-amino-N-(1-tert-butylpiperidin-4-yl)-2-methylpropanamide has a molecular weight of 241.38 g/mol, XLogP of 1.10, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1-tert-butylpiperidin-4-yl)-2-methylpropanamide is sourced from PubChem (CID 61264639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).