2-[1-[[(2R)-piperidine-2-carbonyl]amino]cyclohexyl]acetic acid

C14H24N2O3 — CID 104914061

IUPAC2-[1-[[(2R)-piperidine-2-carbonyl]amino]cyclohexyl]acetic acid
SMILESO=C(O)CC1(NC(=O)[C@H]2CCCCN2)CCCCC1
InChIInChI=1S/C14H24N2O3/c17-12(18)10-14(7-3-1-4-8-14)16-13(19)11-6-2-5-9-15-11/h11,15H,1-10H2,(H,16,19)(H,17,18)/t11-/m1/s1
InChIKeyQTLLLBFTDNMGRE-LLVKDONJSA-N
MW268.36 g/mol
LogP1.42
Rot. Bonds4

About 2-[1-[[(2R)-piperidine-2-carbonyl]amino]cyclohexyl]acetic acid

2-[1-[[(2R)-piperidine-2-carbonyl]amino]cyclohexyl]acetic acid (PubChem CID 104914061) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is 2-[1-[[(2R)-piperidine-2-carbonyl]amino]cyclohexyl]acetic acid.

Molecular Properties

Compound Name2-[1-[[(2R)-piperidine-2-carbonyl]amino]cyclohexyl]acetic acid
PubChem CID104914061
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC Name2-[1-[[(2R)-piperidine-2-carbonyl]amino]cyclohexyl]acetic acid
SMILESO=C(O)CC1(NC(=O)[C@H]2CCCCN2)CCCCC1
InChIInChI=1S/C14H24N2O3/c17-12(18)10-14(7-3-1-4-8-14)16-13(19)11-6-2-5-9-15-11/h11,15H,1-10H2,(H,16,19)(H,17,18)/t11-/m1/s1
InChIKeyQTLLLBFTDNMGRE-LLVKDONJSA-N
XLogP1.42
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 51.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-(thiomorpholine-3-carbonylamino)cyclopentyl]acetic acid
CID 82917741
2-[1-(cyclooctanecarbonylamino)cyclohexyl]acetic acid
CID 65019610
2-[1-[(4-ethylpiperidine-2-carbonyl)amino]cyclopentyl]acetic acid
CID 114429129
2-[1-(cyclopentanecarbonylamino)cyclobutyl]acetic acid
CID 79849092
N-[[1-(hydroxymethyl)cyclopentyl]methyl]piperidine-2-carboxamide
CID 113293938
(2S)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]piperidine-2-carboxamide
CID 104914457
4-ethyl-1-[[(2R)-piperidine-2-carbonyl]amino]cyclohexane-1-carboxylic acid
CID 104913572
2-[1-[[(3S)-piperidine-3-carbonyl]amino]cyclobutyl]acetic acid
CID 81133872
3-(piperidine-2-carbonylamino)propanoic acid
CID 61157644
N-[1-(hydroxymethyl)cyclopentyl]thiomorpholine-3-carboxamide
CID 82908673
azepane-2-carbohydrazide
CID 64570757
2-[1-[(2-methyloxolane-3-carbonyl)amino]cyclopentyl]acetic acid
CID 79760323

Frequently Asked Questions

What is the IUPAC name of 2-[1-[[(2R)-piperidine-2-carbonyl]amino]cyclohexyl]acetic acid?
The IUPAC name of 2-[1-[[(2R)-piperidine-2-carbonyl]amino]cyclohexyl]acetic acid (CID 104914061) is 2-[1-[[(2R)-piperidine-2-carbonyl]amino]cyclohexyl]acetic acid.
What is the SMILES notation for 2-[1-[[(2R)-piperidine-2-carbonyl]amino]cyclohexyl]acetic acid?
The canonical SMILES for 2-[1-[[(2R)-piperidine-2-carbonyl]amino]cyclohexyl]acetic acid is O=C(O)CC1(NC(=O)[C@H]2CCCCN2)CCCCC1.
What is the InChIKey of 2-[1-[[(2R)-piperidine-2-carbonyl]amino]cyclohexyl]acetic acid?
The InChIKey is QTLLLBFTDNMGRE-LLVKDONJSA-N. The full InChI is InChI=1S/C14H24N2O3/c17-12(18)10-14(7-3-1-4-8-14)16-13(19)11-6-2-5-9-15-11/h11,15H,1-10H2,(H,16,19)(H,17,18)/t11-/m1/s1.
What are the key properties of 2-[1-[[(2R)-piperidine-2-carbonyl]amino]cyclohexyl]acetic acid?
2-[1-[[(2R)-piperidine-2-carbonyl]amino]cyclohexyl]acetic acid has a molecular weight of 268.36 g/mol, XLogP of 1.42, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[[(2R)-piperidine-2-carbonyl]amino]cyclohexyl]acetic acid is sourced from PubChem (CID 104914061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).