3-[cyclopropyl-(4-ethylpiperidine-4-carbonyl)amino]propanoic acid

C14H24N2O3 — CID 63128710

IUPAC3-[cyclopropyl-(4-ethylpiperidine-4-carbonyl)amino]propanoic acid
SMILESCCC1(C(=O)N(CCC(=O)O)C2CC2)CCNCC1
InChIInChI=1S/C14H24N2O3/c1-2-14(6-8-15-9-7-14)13(19)16(11-3-4-11)10-5-12(17)18/h11,15H,2-10H2,1H3,(H,17,18)
InChIKeyYPZKXLIFTNQQCQ-UHFFFAOYSA-N
MW268.36 g/mol
LogP1.23
Rot. Bonds6

About 3-[cyclopropyl-(4-ethylpiperidine-4-carbonyl)amino]propanoic acid

3-[cyclopropyl-(4-ethylpiperidine-4-carbonyl)amino]propanoic acid (PubChem CID 63128710) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is 3-[cyclopropyl-(4-ethylpiperidine-4-carbonyl)amino]propanoic acid.

Molecular Properties

Compound Name3-[cyclopropyl-(4-ethylpiperidine-4-carbonyl)amino]propanoic acid
PubChem CID63128710
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC Name3-[cyclopropyl-(4-ethylpiperidine-4-carbonyl)amino]propanoic acid
SMILESCCC1(C(=O)N(CCC(=O)O)C2CC2)CCNCC1
InChIInChI=1S/C14H24N2O3/c1-2-14(6-8-15-9-7-14)13(19)16(11-3-4-11)10-5-12(17)18/h11,15H,2-10H2,1H3,(H,17,18)
InChIKeyYPZKXLIFTNQQCQ-UHFFFAOYSA-N
XLogP1.23
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[cyclopropyl-(3-ethylpyrrolidine-3-carbonyl)amino]propanoic acid
CID 63141640
N-cyclopropyl-N,4-diethylpiperidine-4-carboxamide
CID 63127607
N-cyclopropyl-4-ethyl-N-(2-methoxyethyl)piperidine-4-carboxamide
CID 63128216
3-[tert-butyl-(4-ethylpiperidine-4-carbonyl)amino]propanoic acid
CID 63128579
N-butyl-N-cyclopropyl-3-ethylpyrrolidine-3-carboxamide
CID 63143362
2-[cyclopentyl-(3-ethylpyrrolidine-3-carbonyl)amino]acetic acid
CID 63141424
4-ethyl-N-methyl-N-(4-methylcyclohexyl)piperidine-4-carboxamide
CID 63128518
N-cyclopropyl-4-ethyl-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide
CID 63128438
N-benzyl-N-cyclopropyl-3-ethylpyrrolidine-3-carboxamide
CID 63138591
N-cyclobutyl-N-(3-hydroxypropyl)-4-propylpiperidine-4-carboxamide
CID 102861592
N-butyl-N-cyclopropyl-3-ethylpiperidine-3-carboxamide
CID 63131459
3-[acetyl(cyclopropyl)amino]propanoic acid
CID 60843836

Frequently Asked Questions

What is the IUPAC name of 3-[cyclopropyl-(4-ethylpiperidine-4-carbonyl)amino]propanoic acid?
The IUPAC name of 3-[cyclopropyl-(4-ethylpiperidine-4-carbonyl)amino]propanoic acid (CID 63128710) is 3-[cyclopropyl-(4-ethylpiperidine-4-carbonyl)amino]propanoic acid.
What is the SMILES notation for 3-[cyclopropyl-(4-ethylpiperidine-4-carbonyl)amino]propanoic acid?
The canonical SMILES for 3-[cyclopropyl-(4-ethylpiperidine-4-carbonyl)amino]propanoic acid is CCC1(C(=O)N(CCC(=O)O)C2CC2)CCNCC1.
What is the InChIKey of 3-[cyclopropyl-(4-ethylpiperidine-4-carbonyl)amino]propanoic acid?
The InChIKey is YPZKXLIFTNQQCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3/c1-2-14(6-8-15-9-7-14)13(19)16(11-3-4-11)10-5-12(17)18/h11,15H,2-10H2,1H3,(H,17,18).
What are the key properties of 3-[cyclopropyl-(4-ethylpiperidine-4-carbonyl)amino]propanoic acid?
3-[cyclopropyl-(4-ethylpiperidine-4-carbonyl)amino]propanoic acid has a molecular weight of 268.36 g/mol, XLogP of 1.23, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[cyclopropyl-(4-ethylpiperidine-4-carbonyl)amino]propanoic acid is sourced from PubChem (CID 63128710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).