2-amino-4-(3-methoxypropoxy)-2-methylpentan-1-ol

C10H23NO3 — CID 64810813

IUPAC2-amino-4-(3-methoxypropoxy)-2-methylpentan-1-ol
SMILESCOCCCOC(C)CC(C)(N)CO
InChIInChI=1S/C10H23NO3/c1-9(7-10(2,11)8-12)14-6-4-5-13-3/h9,12H,4-8,11H2,1-3H3
InChIKeyRNSLBIDIBTXOJH-UHFFFAOYSA-N
MW205.30 g/mol
LogP0.53
Rot. Bonds8

About 2-amino-4-(3-methoxypropoxy)-2-methylpentan-1-ol

2-amino-4-(3-methoxypropoxy)-2-methylpentan-1-ol (PubChem CID 64810813) has the molecular formula C10H23NO3 and a molecular weight of 205.30 g/mol. Its IUPAC name is 2-amino-4-(3-methoxypropoxy)-2-methylpentan-1-ol.

Molecular Properties

Compound Name2-amino-4-(3-methoxypropoxy)-2-methylpentan-1-ol
PubChem CID64810813
Molecular FormulaC10H23NO3
Molecular Weight205.30 g/mol
Exact Mass205.17
IUPAC Name2-amino-4-(3-methoxypropoxy)-2-methylpentan-1-ol
SMILESCOCCCOC(C)CC(C)(N)CO
InChIInChI=1S/C10H23NO3/c1-9(7-10(2,11)8-12)14-6-4-5-13-3/h9,12H,4-8,11H2,1-3H3
InChIKeyRNSLBIDIBTXOJH-UHFFFAOYSA-N
XLogP0.53
TPSA64.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-amino-2-methyl-4-(2-propan-2-yloxyethoxy)pentan-1-ol
CID 64802797
4-(3-methoxypropoxy)-2-methyl-2-(propylamino)pentan-1-ol
CID 64810828
2-amino-4-(cyclopropylmethoxy)-2-methylpentan-1-ol
CID 64802601
2-amino-2-methyl-6-pentan-2-yloxyhexan-1-ol
CID 102988227
4-[2-(3-methoxypropoxy)ethoxy]-2-methyl-2-(propylamino)pentan-1-ol
CID 103181446
2-amino-5-[3-(2-methoxyethoxy)propoxy]-2-methylpentan-1-ol
CID 103407415
2-amino-2-methyl-4-(oxan-4-ylmethoxy)pentan-1-ol
CID 64811806
2-amino-4-(4-methoxyphenoxy)-2-methylpentan-1-ol
CID 64802307
3-amino-2-(3-methoxypropoxy)-4,4-dimethylpentan-1-ol
CID 114358200
3-(3-methoxypropoxy)butanimidamide
CID 114995283
2-amino-4-(1-ethoxypropan-2-yloxy)-2-methylpentan-1-ol
CID 103491094
2-amino-3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylpropan-1-ol
CID 113427544

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-(3-methoxypropoxy)-2-methylpentan-1-ol?
The IUPAC name of 2-amino-4-(3-methoxypropoxy)-2-methylpentan-1-ol (CID 64810813) is 2-amino-4-(3-methoxypropoxy)-2-methylpentan-1-ol.
What is the SMILES notation for 2-amino-4-(3-methoxypropoxy)-2-methylpentan-1-ol?
The canonical SMILES for 2-amino-4-(3-methoxypropoxy)-2-methylpentan-1-ol is COCCCOC(C)CC(C)(N)CO.
What is the InChIKey of 2-amino-4-(3-methoxypropoxy)-2-methylpentan-1-ol?
The InChIKey is RNSLBIDIBTXOJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO3/c1-9(7-10(2,11)8-12)14-6-4-5-13-3/h9,12H,4-8,11H2,1-3H3.
What are the key properties of 2-amino-4-(3-methoxypropoxy)-2-methylpentan-1-ol?
2-amino-4-(3-methoxypropoxy)-2-methylpentan-1-ol has a molecular weight of 205.30 g/mol, XLogP of 0.53, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-(3-methoxypropoxy)-2-methylpentan-1-ol is sourced from PubChem (CID 64810813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).