(2-hydroxy-3-methyl-5-propan-2-yloxycyclopentyl)methoxy-N-[5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl]phosphonamidic acid

C19H38NO7P — CID 22965157

IUPAC(2-hydroxy-3-methyl-5-propan-2-yloxycyclopentyl)methoxy-N-[5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl]phosphonamidic acid
SMILESCC(C)OCC1OC(C)CC1NP(=O)(O)OCC1C(OC(C)C)CC(C)C1O
InChIInChI=1S/C19H38NO7P/c1-11(2)24-10-18-16(8-14(6)27-18)20-28(22,23)25-9-15-17(26-12(3)4)7-13(5)19(15)21/h11-19,21H,7-10H2,1-6H3,(H2,20,22,23)
InChIKeyNGVPDEKVFYEZFZ-UHFFFAOYSA-N
MW423.49 g/mol
LogP2.47
Rot. Bonds10

About (2-hydroxy-3-methyl-5-propan-2-yloxycyclopentyl)methoxy-N-[5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl]phosphonamidic acid

(2-hydroxy-3-methyl-5-propan-2-yloxycyclopentyl)methoxy-N-[5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl]phosphonamidic acid (PubChem CID 22965157) has the molecular formula C19H38NO7P and a molecular weight of 423.49 g/mol. Its IUPAC name is (2-hydroxy-3-methyl-5-propan-2-yloxycyclopentyl)methoxy-N-[5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl]phosphonamidic acid.

Molecular Properties

Compound Name(2-hydroxy-3-methyl-5-propan-2-yloxycyclopentyl)methoxy-N-[5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl]phosphonamidic acid
PubChem CID22965157
Molecular FormulaC19H38NO7P
Molecular Weight423.49 g/mol
Exact Mass423.24
IUPAC Name(2-hydroxy-3-methyl-5-propan-2-yloxycyclopentyl)methoxy-N-[5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl]phosphonamidic acid
SMILESCC(C)OCC1OC(C)CC1NP(=O)(O)OCC1C(OC(C)C)CC(C)C1O
InChIInChI=1S/C19H38NO7P/c1-11(2)24-10-18-16(8-14(6)27-18)20-28(22,23)25-9-15-17(26-12(3)4)7-13(5)19(15)21/h11-19,21H,7-10H2,1-6H3,(H2,20,22,23)
InChIKeyNGVPDEKVFYEZFZ-UHFFFAOYSA-N
XLogP2.47
TPSA106.48 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500423.49
LogP ≤ 52.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze (2-hydroxy-3-methyl-5-propan-2-yloxycyclopentyl)methoxy-N-[5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl]phosphonamidic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2-hydroxy-3-methyl-5-propan-2-yloxycyclopentyl)methoxy-N-[5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl]phosphonamidic acid?
The IUPAC name of (2-hydroxy-3-methyl-5-propan-2-yloxycyclopentyl)methoxy-N-[5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl]phosphonamidic acid (CID 22965157) is (2-hydroxy-3-methyl-5-propan-2-yloxycyclopentyl)methoxy-N-[5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl]phosphonamidic acid.
What is the SMILES notation for (2-hydroxy-3-methyl-5-propan-2-yloxycyclopentyl)methoxy-N-[5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl]phosphonamidic acid?
The canonical SMILES for (2-hydroxy-3-methyl-5-propan-2-yloxycyclopentyl)methoxy-N-[5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl]phosphonamidic acid is CC(C)OCC1OC(C)CC1NP(=O)(O)OCC1C(OC(C)C)CC(C)C1O.
What is the InChIKey of (2-hydroxy-3-methyl-5-propan-2-yloxycyclopentyl)methoxy-N-[5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl]phosphonamidic acid?
The InChIKey is NGVPDEKVFYEZFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H38NO7P/c1-11(2)24-10-18-16(8-14(6)27-18)20-28(22,23)25-9-15-17(26-12(3)4)7-13(5)19(15)21/h11-19,21H,7-10H2,1-6H3,(H2,20,22,23).
What are the key properties of (2-hydroxy-3-methyl-5-propan-2-yloxycyclopentyl)methoxy-N-[5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl]phosphonamidic acid?
(2-hydroxy-3-methyl-5-propan-2-yloxycyclopentyl)methoxy-N-[5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl]phosphonamidic acid has a molecular weight of 423.49 g/mol, XLogP of 2.47, 10 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2-hydroxy-3-methyl-5-propan-2-yloxycyclopentyl)methoxy-N-[5-methyl-2-(propan-2-yloxymethyl)oxolan-3-yl]phosphonamidic acid is sourced from PubChem (CID 22965157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).