2-(chlorophosphanylmethylamino)acetic acid

C3H7ClNO2P — CID 57090340

IUPAC2-(chlorophosphanylmethylamino)acetic acid
SMILESO=C(O)CNCPCl
InChIInChI=1S/C3H7ClNO2P/c4-8-2-5-1-3(6)7/h5,8H,1-2H2,(H,6,7)
InChIKeyYUVWOJMBXMZWJP-UHFFFAOYSA-N
MW155.52 g/mol
LogP0.45
Rot. Bonds4

About 2-(chlorophosphanylmethylamino)acetic acid

2-(chlorophosphanylmethylamino)acetic acid (PubChem CID 57090340) has the molecular formula C3H7ClNO2P and a molecular weight of 155.52 g/mol. Its IUPAC name is 2-(chlorophosphanylmethylamino)acetic acid.

Molecular Properties

Compound Name2-(chlorophosphanylmethylamino)acetic acid
PubChem CID57090340
Molecular FormulaC3H7ClNO2P
Molecular Weight155.52 g/mol
Exact Mass154.99
IUPAC Name2-(chlorophosphanylmethylamino)acetic acid
SMILESO=C(O)CNCPCl
InChIInChI=1S/C3H7ClNO2P/c4-8-2-5-1-3(6)7/h5,8H,1-2H2,(H,6,7)
InChIKeyYUVWOJMBXMZWJP-UHFFFAOYSA-N
XLogP0.45
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.52
LogP ≤ 50.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Sarcosine
CID 1088
Glycine, N-methyl-, hydrochloride (1:1)
CID 69483
Sarcosine C-11
CID 73443002
Sarcosine-d3 (methyl-d3)
CID 16213596
N-(phosphoryl-methyl)glycine
CID 129747846
d3-Sarcosine
CID 141242048
2-(Difluorophosphanylmethylamino)acetic acid
CID 57303689
Hydron;2-(methylamino)acetic acid;chloride
CID 74764750
CID 135031025
CID 135031025
Sarcosine, [glycine 1-14C]
CID 12220735
2-(Thiophosphorosomethylamino)acetic acid
CID 20211508
2-(Phosphanylmethylamino)acetic acid
CID 20246459

Frequently Asked Questions

What is the IUPAC name of 2-(chlorophosphanylmethylamino)acetic acid?
The IUPAC name of 2-(chlorophosphanylmethylamino)acetic acid (CID 57090340) is 2-(chlorophosphanylmethylamino)acetic acid.
What is the SMILES notation for 2-(chlorophosphanylmethylamino)acetic acid?
The canonical SMILES for 2-(chlorophosphanylmethylamino)acetic acid is O=C(O)CNCPCl.
What is the InChIKey of 2-(chlorophosphanylmethylamino)acetic acid?
The InChIKey is YUVWOJMBXMZWJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7ClNO2P/c4-8-2-5-1-3(6)7/h5,8H,1-2H2,(H,6,7).
What are the key properties of 2-(chlorophosphanylmethylamino)acetic acid?
2-(chlorophosphanylmethylamino)acetic acid has a molecular weight of 155.52 g/mol, XLogP of 0.45, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(chlorophosphanylmethylamino)acetic acid is sourced from PubChem (CID 57090340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).