2-[(3-cyclopentyl-2-methylpropanoyl)-(2-methylpropyl)amino]acetic acid

C15H27NO3 — CID 119192685

IUPAC2-[(3-cyclopentyl-2-methylpropanoyl)-(2-methylpropyl)amino]acetic acid
SMILESCC(C)CN(CC(=O)O)C(=O)C(C)CC1CCCC1
InChIInChI=1S/C15H27NO3/c1-11(2)9-16(10-14(17)18)15(19)12(3)8-13-6-4-5-7-13/h11-13H,4-10H2,1-3H3,(H,17,18)
InChIKeySRZDCIDSAFRLHF-UHFFFAOYSA-N
MW269.38 g/mol
LogP2.77
Rot. Bonds7

About 2-[(3-cyclopentyl-2-methylpropanoyl)-(2-methylpropyl)amino]acetic acid

2-[(3-cyclopentyl-2-methylpropanoyl)-(2-methylpropyl)amino]acetic acid (PubChem CID 119192685) has the molecular formula C15H27NO3 and a molecular weight of 269.38 g/mol. Its IUPAC name is 2-[(3-cyclopentyl-2-methylpropanoyl)-(2-methylpropyl)amino]acetic acid.

Molecular Properties

Compound Name2-[(3-cyclopentyl-2-methylpropanoyl)-(2-methylpropyl)amino]acetic acid
PubChem CID119192685
Molecular FormulaC15H27NO3
Molecular Weight269.38 g/mol
Exact Mass269.20
IUPAC Name2-[(3-cyclopentyl-2-methylpropanoyl)-(2-methylpropyl)amino]acetic acid
SMILESCC(C)CN(CC(=O)O)C(=O)C(C)CC1CCCC1
InChIInChI=1S/C15H27NO3/c1-11(2)9-16(10-14(17)18)15(19)12(3)8-13-6-4-5-7-13/h11-13H,4-10H2,1-3H3,(H,17,18)
InChIKeySRZDCIDSAFRLHF-UHFFFAOYSA-N
XLogP2.77
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.38
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2-methyl-3-methylsulfanylpropanoyl)-(2-methylpropyl)amino]acetic acid
CID 115730558
2-[2-methylpropyl-[2-(oxan-4-yl)propanoyl]amino]acetic acid
CID 120686043
2-[2-methylpropyl-[(2R)-pyrrolidine-2-carbonyl]amino]acetic acid
CID 103869277
2-[[2-(cyclopentylamino)acetyl]-(2-methylpropyl)amino]acetic acid
CID 55148404
3-[carboxymethyl-(2-cyclohexylacetyl)amino]-2-methylpropanoic acid
CID 82326124
2-cyclopentyl-N,N-bis(2-methylpropyl)acetamide
CID 78797313
2-[1-cyclopentylethyl(2-methylpropyl)amino]acetic acid
CID 65064339
2-[(3-ethylpiperidine-1-carbonyl)-(2-methylpropyl)amino]acetic acid
CID 63064381
2-[cyclopropylmethyl-(2-methyl-3-methylsulfanylpropanoyl)amino]acetic acid
CID 115730572
2-[(2-cyclopentylsulfonylacetyl)-(2-methylpropyl)amino]acetic acid
CID 119193319
2-[cyclopentyl(2-methylpropyl)amino]acetic acid
CID 60835237
2-[cyclopropylmethyl(2-methylbutanoyl)amino]acetic acid
CID 43655102

Frequently Asked Questions

What is the IUPAC name of 2-[(3-cyclopentyl-2-methylpropanoyl)-(2-methylpropyl)amino]acetic acid?
The IUPAC name of 2-[(3-cyclopentyl-2-methylpropanoyl)-(2-methylpropyl)amino]acetic acid (CID 119192685) is 2-[(3-cyclopentyl-2-methylpropanoyl)-(2-methylpropyl)amino]acetic acid.
What is the SMILES notation for 2-[(3-cyclopentyl-2-methylpropanoyl)-(2-methylpropyl)amino]acetic acid?
The canonical SMILES for 2-[(3-cyclopentyl-2-methylpropanoyl)-(2-methylpropyl)amino]acetic acid is CC(C)CN(CC(=O)O)C(=O)C(C)CC1CCCC1.
What is the InChIKey of 2-[(3-cyclopentyl-2-methylpropanoyl)-(2-methylpropyl)amino]acetic acid?
The InChIKey is SRZDCIDSAFRLHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO3/c1-11(2)9-16(10-14(17)18)15(19)12(3)8-13-6-4-5-7-13/h11-13H,4-10H2,1-3H3,(H,17,18).
What are the key properties of 2-[(3-cyclopentyl-2-methylpropanoyl)-(2-methylpropyl)amino]acetic acid?
2-[(3-cyclopentyl-2-methylpropanoyl)-(2-methylpropyl)amino]acetic acid has a molecular weight of 269.38 g/mol, XLogP of 2.77, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-cyclopentyl-2-methylpropanoyl)-(2-methylpropyl)amino]acetic acid is sourced from PubChem (CID 119192685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).