2-[2-(2-aminoethyl)piperidin-1-yl]-N-(3-methylbutan-2-yl)acetamide

C14H29N3O — CID 63760086

IUPAC2-[2-(2-aminoethyl)piperidin-1-yl]-N-(3-methylbutan-2-yl)acetamide
SMILESCC(C)C(C)NC(=O)CN1CCCCC1CCN
InChIInChI=1S/C14H29N3O/c1-11(2)12(3)16-14(18)10-17-9-5-4-6-13(17)7-8-15/h11-13H,4-10,15H2,1-3H3,(H,16,18)
InChIKeyNOKFPXJXPKDRDP-UHFFFAOYSA-N
MW255.41 g/mol
LogP1.35
Rot. Bonds6

About 2-[2-(2-aminoethyl)piperidin-1-yl]-N-(3-methylbutan-2-yl)acetamide

2-[2-(2-aminoethyl)piperidin-1-yl]-N-(3-methylbutan-2-yl)acetamide (PubChem CID 63760086) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is 2-[2-(2-aminoethyl)piperidin-1-yl]-N-(3-methylbutan-2-yl)acetamide.

Molecular Properties

Compound Name2-[2-(2-aminoethyl)piperidin-1-yl]-N-(3-methylbutan-2-yl)acetamide
PubChem CID63760086
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name2-[2-(2-aminoethyl)piperidin-1-yl]-N-(3-methylbutan-2-yl)acetamide
SMILESCC(C)C(C)NC(=O)CN1CCCCC1CCN
InChIInChI=1S/C14H29N3O/c1-11(2)12(3)16-14(18)10-17-9-5-4-6-13(17)7-8-15/h11-13H,4-10,15H2,1-3H3,(H,16,18)
InChIKeyNOKFPXJXPKDRDP-UHFFFAOYSA-N
XLogP1.35
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(ethylaminomethyl)piperidin-1-yl]-N-(3-methylbutan-2-yl)acetamide
CID 63847650
2-[2-(aminomethyl)pyrrolidin-1-yl]-N-propan-2-ylacetamide
CID 63759548
N-butan-2-yl-2-[2-(2-hydroxyethyl)piperidin-1-yl]acetamide
CID 60690066
2-[2-(2-aminoethyl)piperidin-1-yl]-N-(4-methoxyphenyl)acetamide
CID 63759527
N,N-dimethyl-1-[2-(3-methylbutan-2-ylamino)-2-oxoethyl]pyrrolidine-2-carboxamide
CID 134031662
2-[2-(3-aminopropyl)pyrrolidin-1-yl]-N-cyclohexylacetamide
CID 63763550
2-[2-[(2-methylpropylamino)methyl]piperidin-1-yl]-N-propan-2-ylacetamide
CID 63855304
2-(azepan-1-yl)-N-(3-methylbutan-2-yl)acetamide
CID 86908322
2-[2-(aminomethyl)pyrrolidin-1-yl]-N-(propan-2-ylcarbamoyl)acetamide
CID 81492867
N-heptan-2-yl-2-[2-(hydroxymethyl)azepan-1-yl]acetamide
CID 116637510
2-[[2-(2-ethylpiperidin-1-yl)acetyl]amino]-N,N-dimethylpropanamide
CID 87012431
2-(1-hexylpiperidin-2-yl)ethanamine
CID 63759699

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-aminoethyl)piperidin-1-yl]-N-(3-methylbutan-2-yl)acetamide?
The IUPAC name of 2-[2-(2-aminoethyl)piperidin-1-yl]-N-(3-methylbutan-2-yl)acetamide (CID 63760086) is 2-[2-(2-aminoethyl)piperidin-1-yl]-N-(3-methylbutan-2-yl)acetamide.
What is the SMILES notation for 2-[2-(2-aminoethyl)piperidin-1-yl]-N-(3-methylbutan-2-yl)acetamide?
The canonical SMILES for 2-[2-(2-aminoethyl)piperidin-1-yl]-N-(3-methylbutan-2-yl)acetamide is CC(C)C(C)NC(=O)CN1CCCCC1CCN.
What is the InChIKey of 2-[2-(2-aminoethyl)piperidin-1-yl]-N-(3-methylbutan-2-yl)acetamide?
The InChIKey is NOKFPXJXPKDRDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-11(2)12(3)16-14(18)10-17-9-5-4-6-13(17)7-8-15/h11-13H,4-10,15H2,1-3H3,(H,16,18).
What are the key properties of 2-[2-(2-aminoethyl)piperidin-1-yl]-N-(3-methylbutan-2-yl)acetamide?
2-[2-(2-aminoethyl)piperidin-1-yl]-N-(3-methylbutan-2-yl)acetamide has a molecular weight of 255.41 g/mol, XLogP of 1.35, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-aminoethyl)piperidin-1-yl]-N-(3-methylbutan-2-yl)acetamide is sourced from PubChem (CID 63760086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).