N-[bis(phosphanyl)methyl]-5-chloropyridin-2-amine

C6H9ClN2P2 — CID 118465848

IUPACN-[bis(phosphanyl)methyl]-5-chloropyridin-2-amine
SMILESPC(P)Nc1ccc(Cl)cn1
InChIInChI=1S/C6H9ClN2P2/c7-4-1-2-5(8-3-4)9-6(10)11/h1-3,6H,10-11H2,(H,8,9)
InChIKeyXNQDJGUSLNMRMB-UHFFFAOYSA-N
MW206.55 g/mol
LogP2.18
Rot. Bonds2

About N-[bis(phosphanyl)methyl]-5-chloropyridin-2-amine

N-[bis(phosphanyl)methyl]-5-chloropyridin-2-amine (PubChem CID 118465848) has the molecular formula C6H9ClN2P2 and a molecular weight of 206.55 g/mol. Its IUPAC name is N-[bis(phosphanyl)methyl]-5-chloropyridin-2-amine.

Molecular Properties

Compound NameN-[bis(phosphanyl)methyl]-5-chloropyridin-2-amine
PubChem CID118465848
Molecular FormulaC6H9ClN2P2
Molecular Weight206.55 g/mol
Exact Mass205.99
IUPAC NameN-[bis(phosphanyl)methyl]-5-chloropyridin-2-amine
SMILESPC(P)Nc1ccc(Cl)cn1
InChIInChI=1S/C6H9ClN2P2/c7-4-1-2-5(8-3-4)9-6(10)11/h1-3,6H,10-11H2,(H,8,9)
InChIKeyXNQDJGUSLNMRMB-UHFFFAOYSA-N
XLogP2.18
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.55
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[(5-chloro-2-pyridinyl)amino]propane-1,3-diol
CID 65314143
5-chloro-N-(5-methylhexan-2-yl)pyridin-2-amine
CID 63925701
5-chloro-N-[1-(4-methylphenyl)ethyl]pyridin-2-amine
CID 54968175
5-chloro-N-(4,4-difluorobutan-2-yl)pyridin-2-amine
CID 130639953
[[(5-chloro-2-pyridinyl)amino]-[hydroxy(oxo)phosphaniumyl]oxymethoxy]-hydroxy-oxophosphanium
CID 71214104
5-chloro-N-hexan-3-ylpyridin-2-amine
CID 62117278
5-chloro-N-[1-(2,4-dichlorophenyl)ethyl]pyridin-2-amine
CID 43110954
N-[1-(4-aminophenyl)ethyl]-5-chloropyridin-2-amine
CID 60870794
N'-(5-chloro-2-pyridinyl)ethane-1,2-diamine;hydrochloride
CID 18507461
2-[(5-chloro-2-pyridinyl)amino]-4-methylpentan-1-ol
CID 61246447
5-chloro-N-(1-cyclohexylethyl)pyridin-2-amine
CID 62406315
2-[(5-chloro-2-pyridinyl)amino]-2-phenylethanol
CID 55159998

Frequently Asked Questions

What is the IUPAC name of N-[bis(phosphanyl)methyl]-5-chloropyridin-2-amine?
The IUPAC name of N-[bis(phosphanyl)methyl]-5-chloropyridin-2-amine (CID 118465848) is N-[bis(phosphanyl)methyl]-5-chloropyridin-2-amine.
What is the SMILES notation for N-[bis(phosphanyl)methyl]-5-chloropyridin-2-amine?
The canonical SMILES for N-[bis(phosphanyl)methyl]-5-chloropyridin-2-amine is PC(P)Nc1ccc(Cl)cn1.
What is the InChIKey of N-[bis(phosphanyl)methyl]-5-chloropyridin-2-amine?
The InChIKey is XNQDJGUSLNMRMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9ClN2P2/c7-4-1-2-5(8-3-4)9-6(10)11/h1-3,6H,10-11H2,(H,8,9).
What are the key properties of N-[bis(phosphanyl)methyl]-5-chloropyridin-2-amine?
N-[bis(phosphanyl)methyl]-5-chloropyridin-2-amine has a molecular weight of 206.55 g/mol, XLogP of 2.18, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[bis(phosphanyl)methyl]-5-chloropyridin-2-amine is sourced from PubChem (CID 118465848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).