2-[ethyl-(4-hydroxypyrrolidin-3-yl)amino]-N-propan-2-ylacetamide

C11H23N3O2 — CID 63701851

IUPAC2-[ethyl-(4-hydroxypyrrolidin-3-yl)amino]-N-propan-2-ylacetamide
SMILESCCN(CC(=O)NC(C)C)C1CNCC1O
InChIInChI=1S/C11H23N3O2/c1-4-14(7-11(16)13-8(2)3)9-5-12-6-10(9)15/h8-10,12,15H,4-7H2,1-3H3,(H,13,16)
InChIKeyGHHALVKPNLOMHY-UHFFFAOYSA-N
MW229.32 g/mol
LogP-0.83
Rot. Bonds5

About 2-[ethyl-(4-hydroxypyrrolidin-3-yl)amino]-N-propan-2-ylacetamide

2-[ethyl-(4-hydroxypyrrolidin-3-yl)amino]-N-propan-2-ylacetamide (PubChem CID 63701851) has the molecular formula C11H23N3O2 and a molecular weight of 229.32 g/mol. Its IUPAC name is 2-[ethyl-(4-hydroxypyrrolidin-3-yl)amino]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[ethyl-(4-hydroxypyrrolidin-3-yl)amino]-N-propan-2-ylacetamide
PubChem CID63701851
Molecular FormulaC11H23N3O2
Molecular Weight229.32 g/mol
Exact Mass229.18
IUPAC Name2-[ethyl-(4-hydroxypyrrolidin-3-yl)amino]-N-propan-2-ylacetamide
SMILESCCN(CC(=O)NC(C)C)C1CNCC1O
InChIInChI=1S/C11H23N3O2/c1-4-14(7-11(16)13-8(2)3)9-5-12-6-10(9)15/h8-10,12,15H,4-7H2,1-3H3,(H,13,16)
InChIKeyGHHALVKPNLOMHY-UHFFFAOYSA-N
XLogP-0.83
TPSA64.60 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 5-0.83
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-(4-hydroxypyrrolidin-3-yl)amino]-N-propan-2-ylacetamide?
The IUPAC name of 2-[ethyl-(4-hydroxypyrrolidin-3-yl)amino]-N-propan-2-ylacetamide (CID 63701851) is 2-[ethyl-(4-hydroxypyrrolidin-3-yl)amino]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[ethyl-(4-hydroxypyrrolidin-3-yl)amino]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[ethyl-(4-hydroxypyrrolidin-3-yl)amino]-N-propan-2-ylacetamide is CCN(CC(=O)NC(C)C)C1CNCC1O.
What is the InChIKey of 2-[ethyl-(4-hydroxypyrrolidin-3-yl)amino]-N-propan-2-ylacetamide?
The InChIKey is GHHALVKPNLOMHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O2/c1-4-14(7-11(16)13-8(2)3)9-5-12-6-10(9)15/h8-10,12,15H,4-7H2,1-3H3,(H,13,16).
What are the key properties of 2-[ethyl-(4-hydroxypyrrolidin-3-yl)amino]-N-propan-2-ylacetamide?
2-[ethyl-(4-hydroxypyrrolidin-3-yl)amino]-N-propan-2-ylacetamide has a molecular weight of 229.32 g/mol, XLogP of -0.83, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-(4-hydroxypyrrolidin-3-yl)amino]-N-propan-2-ylacetamide is sourced from PubChem (CID 63701851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).