N-(5-aminopentan-2-yl)-2-(methylamino)acetamide

C8H19N3O — CID 20823711

IUPACN-(5-aminopentan-2-yl)-2-(methylamino)acetamide
SMILESCNCC(=O)NC(C)CCCN
InChIInChI=1S/C8H19N3O/c1-7(4-3-5-9)11-8(12)6-10-2/h7,10H,3-6,9H2,1-2H3,(H,11,12)
InChIKeyPGDOJKTUNCAVMF-UHFFFAOYSA-N
MW173.26 g/mol
LogP-0.55
Rot. Bonds6

About N-(5-aminopentan-2-yl)-2-(methylamino)acetamide

N-(5-aminopentan-2-yl)-2-(methylamino)acetamide (PubChem CID 20823711) has the molecular formula C8H19N3O and a molecular weight of 173.26 g/mol. Its IUPAC name is N-(5-aminopentan-2-yl)-2-(methylamino)acetamide.

Molecular Properties

Compound NameN-(5-aminopentan-2-yl)-2-(methylamino)acetamide
PubChem CID20823711
Molecular FormulaC8H19N3O
Molecular Weight173.26 g/mol
Exact Mass173.15
IUPAC NameN-(5-aminopentan-2-yl)-2-(methylamino)acetamide
SMILESCNCC(=O)NC(C)CCCN
InChIInChI=1S/C8H19N3O/c1-7(4-3-5-9)11-8(12)6-10-2/h7,10H,3-6,9H2,1-2H3,(H,11,12)
InChIKeyPGDOJKTUNCAVMF-UHFFFAOYSA-N
XLogP-0.55
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 5-0.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(5-aminopentan-2-yl)-2-(methylamino)acetamide?
The IUPAC name of N-(5-aminopentan-2-yl)-2-(methylamino)acetamide (CID 20823711) is N-(5-aminopentan-2-yl)-2-(methylamino)acetamide.
What is the SMILES notation for N-(5-aminopentan-2-yl)-2-(methylamino)acetamide?
The canonical SMILES for N-(5-aminopentan-2-yl)-2-(methylamino)acetamide is CNCC(=O)NC(C)CCCN.
What is the InChIKey of N-(5-aminopentan-2-yl)-2-(methylamino)acetamide?
The InChIKey is PGDOJKTUNCAVMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N3O/c1-7(4-3-5-9)11-8(12)6-10-2/h7,10H,3-6,9H2,1-2H3,(H,11,12).
What are the key properties of N-(5-aminopentan-2-yl)-2-(methylamino)acetamide?
N-(5-aminopentan-2-yl)-2-(methylamino)acetamide has a molecular weight of 173.26 g/mol, XLogP of -0.55, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-aminopentan-2-yl)-2-(methylamino)acetamide is sourced from PubChem (CID 20823711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).