4-amino-N-(2-hydroxyethyl)-N-pentan-3-yloxolane-3-carboxamide

C12H24N2O3 — CID 66236680

IUPAC4-amino-N-(2-hydroxyethyl)-N-pentan-3-yloxolane-3-carboxamide
SMILESCCC(CC)N(CCO)C(=O)C1COCC1N
InChIInChI=1S/C12H24N2O3/c1-3-9(4-2)14(5-6-15)12(16)10-7-17-8-11(10)13/h9-11,15H,3-8,13H2,1-2H3
InChIKeyJNOFZOXGSYWNEI-UHFFFAOYSA-N
MW244.33 g/mol
LogP-0.03
Rot. Bonds6

About 4-amino-N-(2-hydroxyethyl)-N-pentan-3-yloxolane-3-carboxamide

4-amino-N-(2-hydroxyethyl)-N-pentan-3-yloxolane-3-carboxamide (PubChem CID 66236680) has the molecular formula C12H24N2O3 and a molecular weight of 244.33 g/mol. Its IUPAC name is 4-amino-N-(2-hydroxyethyl)-N-pentan-3-yloxolane-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(2-hydroxyethyl)-N-pentan-3-yloxolane-3-carboxamide
PubChem CID66236680
Molecular FormulaC12H24N2O3
Molecular Weight244.33 g/mol
Exact Mass244.18
IUPAC Name4-amino-N-(2-hydroxyethyl)-N-pentan-3-yloxolane-3-carboxamide
SMILESCCC(CC)N(CCO)C(=O)C1COCC1N
InChIInChI=1S/C12H24N2O3/c1-3-9(4-2)14(5-6-15)12(16)10-7-17-8-11(10)13/h9-11,15H,3-8,13H2,1-2H3
InChIKeyJNOFZOXGSYWNEI-UHFFFAOYSA-N
XLogP-0.03
TPSA75.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.33
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-(2-methylpropyl)-N-pentan-3-yloxolane-3-carboxamide
CID 79490741
4-amino-N,N-bis(2-hydroxyethyl)oxolane-3-carboxamide
CID 66237461
4-amino-N-ethyl-N-propan-2-yloxolane-3-carboxamide
CID 66238409
4-amino-N-pentyl-N-propan-2-yloxolane-3-carboxamide
CID 66238860
4-amino-N-cyclobutyl-N-(2-hydroxyethyl)oxolane-3-carboxamide
CID 102862095
4-amino-N-[1-(dimethylamino)propan-2-yl]-N-ethyloxolane-3-carboxamide
CID 103188603
4-amino-N-ethyl-N-methyloxolane-3-carboxamide
CID 66238406
2-[(4-aminooxolane-3-carbonyl)-methylamino]butanoic acid
CID 66235466
2-[(4-aminooxolane-3-carbonyl)-propylamino]acetic acid
CID 66235465
N-(2-hydroxyethyl)-2-methyl-N-pentan-3-ylpyrrolidine-3-carboxamide
CID 79388801
4-amino-N-(1-hydroxybutan-2-yl)oxolane-3-carboxamide
CID 66240011
4-amino-N-(1-cyanopropan-2-yl)-N-methyloxolane-3-carboxamide
CID 66237705

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2-hydroxyethyl)-N-pentan-3-yloxolane-3-carboxamide?
The IUPAC name of 4-amino-N-(2-hydroxyethyl)-N-pentan-3-yloxolane-3-carboxamide (CID 66236680) is 4-amino-N-(2-hydroxyethyl)-N-pentan-3-yloxolane-3-carboxamide.
What is the SMILES notation for 4-amino-N-(2-hydroxyethyl)-N-pentan-3-yloxolane-3-carboxamide?
The canonical SMILES for 4-amino-N-(2-hydroxyethyl)-N-pentan-3-yloxolane-3-carboxamide is CCC(CC)N(CCO)C(=O)C1COCC1N.
What is the InChIKey of 4-amino-N-(2-hydroxyethyl)-N-pentan-3-yloxolane-3-carboxamide?
The InChIKey is JNOFZOXGSYWNEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O3/c1-3-9(4-2)14(5-6-15)12(16)10-7-17-8-11(10)13/h9-11,15H,3-8,13H2,1-2H3.
What are the key properties of 4-amino-N-(2-hydroxyethyl)-N-pentan-3-yloxolane-3-carboxamide?
4-amino-N-(2-hydroxyethyl)-N-pentan-3-yloxolane-3-carboxamide has a molecular weight of 244.33 g/mol, XLogP of -0.03, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2-hydroxyethyl)-N-pentan-3-yloxolane-3-carboxamide is sourced from PubChem (CID 66236680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).