N-cyclopentyl-2-[(2-hydroxy-2-methylbutyl)amino]acetamide

C12H24N2O2 — CID 65111256

IUPACN-cyclopentyl-2-[(2-hydroxy-2-methylbutyl)amino]acetamide
SMILESCCC(C)(O)CNCC(=O)NC1CCCC1
InChIInChI=1S/C12H24N2O2/c1-3-12(2,16)9-13-8-11(15)14-10-6-4-5-7-10/h10,13,16H,3-9H2,1-2H3,(H,14,15)
InChIKeyWOIINBCXXIGQQG-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.80
Rot. Bonds6

About N-cyclopentyl-2-[(2-hydroxy-2-methylbutyl)amino]acetamide

N-cyclopentyl-2-[(2-hydroxy-2-methylbutyl)amino]acetamide (PubChem CID 65111256) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is N-cyclopentyl-2-[(2-hydroxy-2-methylbutyl)amino]acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[(2-hydroxy-2-methylbutyl)amino]acetamide
PubChem CID65111256
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC NameN-cyclopentyl-2-[(2-hydroxy-2-methylbutyl)amino]acetamide
SMILESCCC(C)(O)CNCC(=O)NC1CCCC1
InChIInChI=1S/C12H24N2O2/c1-3-12(2,16)9-13-8-11(15)14-10-6-4-5-7-10/h10,13,16H,3-9H2,1-2H3,(H,14,15)
InChIKeyWOIINBCXXIGQQG-UHFFFAOYSA-N
XLogP0.80
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[(2-hydroxy-2-methylbutyl)amino]acetamide?
The IUPAC name of N-cyclopentyl-2-[(2-hydroxy-2-methylbutyl)amino]acetamide (CID 65111256) is N-cyclopentyl-2-[(2-hydroxy-2-methylbutyl)amino]acetamide.
What is the SMILES notation for N-cyclopentyl-2-[(2-hydroxy-2-methylbutyl)amino]acetamide?
The canonical SMILES for N-cyclopentyl-2-[(2-hydroxy-2-methylbutyl)amino]acetamide is CCC(C)(O)CNCC(=O)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-[(2-hydroxy-2-methylbutyl)amino]acetamide?
The InChIKey is WOIINBCXXIGQQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-3-12(2,16)9-13-8-11(15)14-10-6-4-5-7-10/h10,13,16H,3-9H2,1-2H3,(H,14,15).
What are the key properties of N-cyclopentyl-2-[(2-hydroxy-2-methylbutyl)amino]acetamide?
N-cyclopentyl-2-[(2-hydroxy-2-methylbutyl)amino]acetamide has a molecular weight of 228.34 g/mol, XLogP of 0.80, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[(2-hydroxy-2-methylbutyl)amino]acetamide is sourced from PubChem (CID 65111256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).