2-(cyclopentanecarbonylamino)-2-cyclopropylpropanoic acid

C12H19NO3 — CID 43163071

IUPAC2-(cyclopentanecarbonylamino)-2-cyclopropylpropanoic acid
SMILESCC(NC(=O)C1CCCC1)(C(=O)O)C1CC1
InChIInChI=1S/C12H19NO3/c1-12(11(15)16,9-6-7-9)13-10(14)8-4-2-3-5-8/h8-9H,2-7H2,1H3,(H,13,14)(H,15,16)
InChIKeyCQACNNPKJLZJRT-UHFFFAOYSA-N
MW225.29 g/mol
LogP1.55
Rot. Bonds4

About 2-(cyclopentanecarbonylamino)-2-cyclopropylpropanoic acid

2-(cyclopentanecarbonylamino)-2-cyclopropylpropanoic acid (PubChem CID 43163071) has the molecular formula C12H19NO3 and a molecular weight of 225.29 g/mol. Its IUPAC name is 2-(cyclopentanecarbonylamino)-2-cyclopropylpropanoic acid.

Molecular Properties

Compound Name2-(cyclopentanecarbonylamino)-2-cyclopropylpropanoic acid
PubChem CID43163071
Molecular FormulaC12H19NO3
Molecular Weight225.29 g/mol
Exact Mass225.14
IUPAC Name2-(cyclopentanecarbonylamino)-2-cyclopropylpropanoic acid
SMILESCC(NC(=O)C1CCCC1)(C(=O)O)C1CC1
InChIInChI=1S/C12H19NO3/c1-12(11(15)16,9-6-7-9)13-10(14)8-4-2-3-5-8/h8-9H,2-7H2,1H3,(H,13,14)(H,15,16)
InChIKeyCQACNNPKJLZJRT-UHFFFAOYSA-N
XLogP1.55
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(4-aminocyclohexanecarbonyl)amino]-2-cyclopropylpropanoic acid
CID 61162345
2-[3-(cyclopentanecarbonylamino)propanoylamino]-2-cyclopropylpropanoic acid
CID 43172564
2-[(4-butylcyclohexanecarbonyl)amino]-2-cyclopropylpropanoic acid
CID 43341292
2-cyclopropyl-2-[(2-methylpiperidine-4-carbonyl)amino]propanoic acid
CID 106739615
N-tert-butylcyclooctanecarboxamide
CID 65022804
2-cyclopropyl-2-[(2-methylpyrrolidine-3-carbonyl)amino]propanoic acid
CID 79389266
2-cyclopropyl-2-[(3-methyloxane-4-carbonyl)amino]propanoic acid
CID 114240910
2-cyclopropyl-2-[(5-methyloxolane-2-carbonyl)amino]propanoic acid
CID 81324373
2-cyclopropyl-2-[(2,2-difluoroacetyl)amino]propanoic acid
CID 103513145
2-cyclopropyl-2-(prop-2-ynylcarbamoylamino)propanoic acid
CID 24708312
2-cyclopropyl-2-[[2-(propan-2-ylamino)acetyl]amino]propanoic acid
CID 61161568
2-cyclopropyl-2-[[1-(2-methylpropyl)-5-oxopyrrolidine-3-carbonyl]amino]propanoic acid
CID 43172528

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentanecarbonylamino)-2-cyclopropylpropanoic acid?
The IUPAC name of 2-(cyclopentanecarbonylamino)-2-cyclopropylpropanoic acid (CID 43163071) is 2-(cyclopentanecarbonylamino)-2-cyclopropylpropanoic acid.
What is the SMILES notation for 2-(cyclopentanecarbonylamino)-2-cyclopropylpropanoic acid?
The canonical SMILES for 2-(cyclopentanecarbonylamino)-2-cyclopropylpropanoic acid is CC(NC(=O)C1CCCC1)(C(=O)O)C1CC1.
What is the InChIKey of 2-(cyclopentanecarbonylamino)-2-cyclopropylpropanoic acid?
The InChIKey is CQACNNPKJLZJRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO3/c1-12(11(15)16,9-6-7-9)13-10(14)8-4-2-3-5-8/h8-9H,2-7H2,1H3,(H,13,14)(H,15,16).
What are the key properties of 2-(cyclopentanecarbonylamino)-2-cyclopropylpropanoic acid?
2-(cyclopentanecarbonylamino)-2-cyclopropylpropanoic acid has a molecular weight of 225.29 g/mol, XLogP of 1.55, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentanecarbonylamino)-2-cyclopropylpropanoic acid is sourced from PubChem (CID 43163071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).