5-(2-phosphanylethoxy)pentan-1-amine

C7H18NOP — CID 170373947

IUPAC5-(2-phosphanylethoxy)pentan-1-amine
SMILESNCCCCCOCCP
InChIInChI=1S/C7H18NOP/c8-4-2-1-3-5-9-6-7-10/h1-8,10H2
InChIKeyNVKXLUAJHCSKQV-UHFFFAOYSA-N
MW163.20 g/mol
LogP1.01
Rot. Bonds7

About 5-(2-phosphanylethoxy)pentan-1-amine

5-(2-phosphanylethoxy)pentan-1-amine (PubChem CID 170373947) has the molecular formula C7H18NOP and a molecular weight of 163.20 g/mol. Its IUPAC name is 5-(2-phosphanylethoxy)pentan-1-amine.

Molecular Properties

Compound Name5-(2-phosphanylethoxy)pentan-1-amine
PubChem CID170373947
Molecular FormulaC7H18NOP
Molecular Weight163.20 g/mol
Exact Mass163.11
IUPAC Name5-(2-phosphanylethoxy)pentan-1-amine
SMILESNCCCCCOCCP
InChIInChI=1S/C7H18NOP/c8-4-2-1-3-5-9-6-7-10/h1-8,10H2
InChIKeyNVKXLUAJHCSKQV-UHFFFAOYSA-N
XLogP1.01
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.20
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 5-(2-phosphanylethoxy)pentan-1-amine with MolForge

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

Launch Full Analysis

Related Compounds

11-(11-aminoundecoxy)undecan-1-amine
CID 19099845
6-[2-(3-aminopropoxy)ethoxy]hexan-1-amine
CID 87252227
5-(2-aminoethoxy)pentan-1-amine
CID 58473832
4-[2-(4-aminobutoxy)ethoxy]butan-1-amine
CID 87873641
4-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]butan-1-amine
CID 22901826
4-nonoxybutan-1-amine
CID 139664551
2-(5-aminopentoxy)ethylazanium
CID 171066071
4-(2-aminoethoxy)butan-1-amine;ethane
CID 171066196
(Z)-13-(4-aminobutoxy)tridec-5-en-1-amine
CID 89036460
6-[2-(2-methoxyethoxy)ethoxy]hexan-1-amine
CID 104566819
6-[2-[2-(2-butoxyethoxy)ethoxy]ethoxy]hexan-1-amine
CID 104566998
4-(4-propoxybutoxy)butan-1-amine
CID 87914116

Frequently Asked Questions

What is the IUPAC name of 5-(2-phosphanylethoxy)pentan-1-amine?
The IUPAC name of 5-(2-phosphanylethoxy)pentan-1-amine (CID 170373947) is 5-(2-phosphanylethoxy)pentan-1-amine.
What is the SMILES notation for 5-(2-phosphanylethoxy)pentan-1-amine?
The canonical SMILES for 5-(2-phosphanylethoxy)pentan-1-amine is NCCCCCOCCP.
What is the InChIKey of 5-(2-phosphanylethoxy)pentan-1-amine?
The InChIKey is NVKXLUAJHCSKQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18NOP/c8-4-2-1-3-5-9-6-7-10/h1-8,10H2.
What are the key properties of 5-(2-phosphanylethoxy)pentan-1-amine?
5-(2-phosphanylethoxy)pentan-1-amine has a molecular weight of 163.20 g/mol, XLogP of 1.01, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-phosphanylethoxy)pentan-1-amine is sourced from PubChem (CID 170373947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).