2-[cyclopropylmethyl-(4-ethylpiperidine-2-carbonyl)amino]acetic acid

C14H24N2O3 — CID 114428663

IUPAC2-[cyclopropylmethyl-(4-ethylpiperidine-2-carbonyl)amino]acetic acid
SMILESCCC1CCNC(C(=O)N(CC(=O)O)CC2CC2)C1
InChIInChI=1S/C14H24N2O3/c1-2-10-5-6-15-12(7-10)14(19)16(9-13(17)18)8-11-3-4-11/h10-12,15H,2-9H2,1H3,(H,17,18)
InChIKeyGGFXTVGTFCIMSA-UHFFFAOYSA-N
MW268.36 g/mol
LogP1.09
Rot. Bonds6

About 2-[cyclopropylmethyl-(4-ethylpiperidine-2-carbonyl)amino]acetic acid

2-[cyclopropylmethyl-(4-ethylpiperidine-2-carbonyl)amino]acetic acid (PubChem CID 114428663) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is 2-[cyclopropylmethyl-(4-ethylpiperidine-2-carbonyl)amino]acetic acid.

Molecular Properties

Compound Name2-[cyclopropylmethyl-(4-ethylpiperidine-2-carbonyl)amino]acetic acid
PubChem CID114428663
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC Name2-[cyclopropylmethyl-(4-ethylpiperidine-2-carbonyl)amino]acetic acid
SMILESCCC1CCNC(C(=O)N(CC(=O)O)CC2CC2)C1
InChIInChI=1S/C14H24N2O3/c1-2-10-5-6-15-12(7-10)14(19)16(9-13(17)18)8-11-3-4-11/h10-12,15H,2-9H2,1H3,(H,17,18)
InChIKeyGGFXTVGTFCIMSA-UHFFFAOYSA-N
XLogP1.09
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 ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(4-ethylpiperidine-2-carbonyl)-(2,2,2-trifluoroethyl)amino]acetic acid
CID 114429250
N,N-dibutyl-4-ethylpiperidine-2-carboxamide
CID 114428005
N,4-diethyl-N-(oxolan-3-ylmethyl)piperidine-2-carboxamide
CID 114428566
2-[cyclopropylmethyl(1,3-thiazolidine-4-carbonyl)amino]acetic acid
CID 61161421
N,4-diethyl-N-prop-2-ynylpiperidine-2-carboxamide
CID 114429394
4-ethyl-N-methyl-N-[(2-methylcyclopropyl)methyl]piperidine-2-carboxamide
CID 114429063
N-butan-2-yl-N,4-diethylpiperidine-2-carboxamide
CID 114428039
4-ethyl-N-methyl-N-(4-methylpentan-2-yl)piperidine-2-carboxamide
CID 114428433
4-ethyl-N-methyl-N-(1-methylpiperidin-4-yl)piperidine-2-carboxamide
CID 114427893
2-[cyclopropylmethyl-(3-ethylcyclopentyl)amino]acetic acid
CID 65055054
2-[ethyl-[(2R)-piperidine-2-carbonyl]amino]acetic acid
CID 104913780
2-[propyl-[(2R)-pyrrolidine-2-carbonyl]amino]acetic acid
CID 103869567

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropylmethyl-(4-ethylpiperidine-2-carbonyl)amino]acetic acid?
The IUPAC name of 2-[cyclopropylmethyl-(4-ethylpiperidine-2-carbonyl)amino]acetic acid (CID 114428663) is 2-[cyclopropylmethyl-(4-ethylpiperidine-2-carbonyl)amino]acetic acid.
What is the SMILES notation for 2-[cyclopropylmethyl-(4-ethylpiperidine-2-carbonyl)amino]acetic acid?
The canonical SMILES for 2-[cyclopropylmethyl-(4-ethylpiperidine-2-carbonyl)amino]acetic acid is CCC1CCNC(C(=O)N(CC(=O)O)CC2CC2)C1.
What is the InChIKey of 2-[cyclopropylmethyl-(4-ethylpiperidine-2-carbonyl)amino]acetic acid?
The InChIKey is GGFXTVGTFCIMSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3/c1-2-10-5-6-15-12(7-10)14(19)16(9-13(17)18)8-11-3-4-11/h10-12,15H,2-9H2,1H3,(H,17,18).
What are the key properties of 2-[cyclopropylmethyl-(4-ethylpiperidine-2-carbonyl)amino]acetic acid?
2-[cyclopropylmethyl-(4-ethylpiperidine-2-carbonyl)amino]acetic acid has a molecular weight of 268.36 g/mol, XLogP of 1.09, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropylmethyl-(4-ethylpiperidine-2-carbonyl)amino]acetic acid is sourced from PubChem (CID 114428663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).