N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-(cyclopropylmethylamino)acetamide

C13H24N4O2 — CID 60868376

IUPACN-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-(cyclopropylmethylamino)acetamide
SMILESNC(=O)CN1CCC(NC(=O)CNCC2CC2)CC1
InChIInChI=1S/C13H24N4O2/c14-12(18)9-17-5-3-11(4-6-17)16-13(19)8-15-7-10-1-2-10/h10-11,15H,1-9H2,(H2,14,18)(H,16,19)
InChIKeyARKSVMVUOPTARF-UHFFFAOYSA-N
MW268.36 g/mol
LogP-0.95
Rot. Bonds7

About N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-(cyclopropylmethylamino)acetamide

N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-(cyclopropylmethylamino)acetamide (PubChem CID 60868376) has the molecular formula C13H24N4O2 and a molecular weight of 268.36 g/mol. Its IUPAC name is N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-(cyclopropylmethylamino)acetamide.

Molecular Properties

Compound NameN-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-(cyclopropylmethylamino)acetamide
PubChem CID60868376
Molecular FormulaC13H24N4O2
Molecular Weight268.36 g/mol
Exact Mass268.19
IUPAC NameN-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-(cyclopropylmethylamino)acetamide
SMILESNC(=O)CN1CCC(NC(=O)CNCC2CC2)CC1
InChIInChI=1S/C13H24N4O2/c14-12(18)9-17-5-3-11(4-6-17)16-13(19)8-15-7-10-1-2-10/h10-11,15H,1-9H2,(H2,14,18)(H,16,19)
InChIKeyARKSVMVUOPTARF-UHFFFAOYSA-N
XLogP-0.95
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 5-0.95
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-(cyclopropylmethylamino)acetamide?
The IUPAC name of N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-(cyclopropylmethylamino)acetamide (CID 60868376) is N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-(cyclopropylmethylamino)acetamide.
What is the SMILES notation for N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-(cyclopropylmethylamino)acetamide?
The canonical SMILES for N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-(cyclopropylmethylamino)acetamide is NC(=O)CN1CCC(NC(=O)CNCC2CC2)CC1.
What is the InChIKey of N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-(cyclopropylmethylamino)acetamide?
The InChIKey is ARKSVMVUOPTARF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O2/c14-12(18)9-17-5-3-11(4-6-17)16-13(19)8-15-7-10-1-2-10/h10-11,15H,1-9H2,(H2,14,18)(H,16,19).
What are the key properties of N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-(cyclopropylmethylamino)acetamide?
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-(cyclopropylmethylamino)acetamide has a molecular weight of 268.36 g/mol, XLogP of -0.95, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-(cyclopropylmethylamino)acetamide is sourced from PubChem (CID 60868376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).