2-[[2-(cyclopentylamino)acetyl]amino]acetic acid

C9H16N2O3 — CID 61158187

IUPAC2-[[2-(cyclopentylamino)acetyl]amino]acetic acid
SMILESO=C(O)CNC(=O)CNC1CCCC1
InChIInChI=1S/C9H16N2O3/c12-8(11-6-9(13)14)5-10-7-3-1-2-4-7/h7,10H,1-6H2,(H,11,12)(H,13,14)
InChIKeyVFEDUFZHKLZOEE-UHFFFAOYSA-N
MW200.24 g/mol
LogP-0.28
Rot. Bonds5

About 2-[[2-(cyclopentylamino)acetyl]amino]acetic acid

2-[[2-(cyclopentylamino)acetyl]amino]acetic acid (PubChem CID 61158187) has the molecular formula C9H16N2O3 and a molecular weight of 200.24 g/mol. Its IUPAC name is 2-[[2-(cyclopentylamino)acetyl]amino]acetic acid.

Molecular Properties

Compound Name2-[[2-(cyclopentylamino)acetyl]amino]acetic acid
PubChem CID61158187
Molecular FormulaC9H16N2O3
Molecular Weight200.24 g/mol
Exact Mass200.12
IUPAC Name2-[[2-(cyclopentylamino)acetyl]amino]acetic acid
SMILESO=C(O)CNC(=O)CNC1CCCC1
InChIInChI=1S/C9H16N2O3/c12-8(11-6-9(13)14)5-10-7-3-1-2-4-7/h7,10H,1-6H2,(H,11,12)(H,13,14)
InChIKeyVFEDUFZHKLZOEE-UHFFFAOYSA-N
XLogP-0.28
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 5-0.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

sodium;2-(cyclohexylamino)acetic acid;hydroxide
CID 164959041
2-(cyclododecylamino)-N-ethylacetamide
CID 43399943
2-(cyclooctylamino)-N-ethylacetamide
CID 28575760
2-[[2-[[(1R,2R)-2-hydroxycyclohexyl]amino]acetyl]amino]acetic acid
CID 18528605
2-(cyclohexylamino)-N-(cyclopropylmethyl)acetamide
CID 28565073
2-(cyclopropylamino)acetic acid
CID 21197388
2-[[2-[(2-cyclopentylacetyl)amino]acetyl]amino]acetic acid
CID 60657329
2-(cyclohexylamino)acetic acid;cyclopentanecarboxylic acid
CID 174421767
5-[[2-(cyclopentylamino)acetyl]amino]-4-methylpentanoic acid
CID 82689279
N-(cyanomethyl)-2-(cyclohexylamino)acetamide
CID 28565070
N-benzyl-2-(cyclopentylamino)acetamide
CID 43084459
2-(cyclooctylamino)-N-methylacetamide
CID 28575796

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(cyclopentylamino)acetyl]amino]acetic acid?
The IUPAC name of 2-[[2-(cyclopentylamino)acetyl]amino]acetic acid (CID 61158187) is 2-[[2-(cyclopentylamino)acetyl]amino]acetic acid.
What is the SMILES notation for 2-[[2-(cyclopentylamino)acetyl]amino]acetic acid?
The canonical SMILES for 2-[[2-(cyclopentylamino)acetyl]amino]acetic acid is O=C(O)CNC(=O)CNC1CCCC1.
What is the InChIKey of 2-[[2-(cyclopentylamino)acetyl]amino]acetic acid?
The InChIKey is VFEDUFZHKLZOEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O3/c12-8(11-6-9(13)14)5-10-7-3-1-2-4-7/h7,10H,1-6H2,(H,11,12)(H,13,14).
What are the key properties of 2-[[2-(cyclopentylamino)acetyl]amino]acetic acid?
2-[[2-(cyclopentylamino)acetyl]amino]acetic acid has a molecular weight of 200.24 g/mol, XLogP of -0.28, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(cyclopentylamino)acetyl]amino]acetic acid is sourced from PubChem (CID 61158187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).