potassium;hydride;(2R)-2-(tetradecylamino)pentanedioic acid

C19H38KNO4 — CID 174683925

IUPACpotassium;hydride;(2R)-2-(tetradecylamino)pentanedioic acid
SMILESCCCCCCCCCCCCCCN[C@H](CCC(=O)O)C(=O)O.[H-].[K+]
InChIInChI=1S/C19H37NO4.K.H/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-20-17(19(23)24)14-15-18(21)22;;/h17,20H,2-16H2,1H3,(H,21,22)(H,23,24);;/q;+1;-1/t17-;;/m1../s1
InChIKeyQUQBDPKRWYTMNC-ZEECNFPPSA-N
MW383.61 g/mol
LogP1.71
Rot. Bonds18

About potassium;hydride;(2R)-2-(tetradecylamino)pentanedioic acid

potassium;hydride;(2R)-2-(tetradecylamino)pentanedioic acid (PubChem CID 174683925) has the molecular formula C19H38KNO4 and a molecular weight of 383.61 g/mol. Its IUPAC name is potassium;hydride;(2R)-2-(tetradecylamino)pentanedioic acid.

Molecular Properties

Compound Namepotassium;hydride;(2R)-2-(tetradecylamino)pentanedioic acid
PubChem CID174683925
Molecular FormulaC19H38KNO4
Molecular Weight383.61 g/mol
Exact Mass383.24
IUPAC Namepotassium;hydride;(2R)-2-(tetradecylamino)pentanedioic acid
SMILESCCCCCCCCCCCCCCN[C@H](CCC(=O)O)C(=O)O.[H-].[K+]
InChIInChI=1S/C19H37NO4.K.H/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-20-17(19(23)24)14-15-18(21)22;;/h17,20H,2-16H2,1H3,(H,21,22)(H,23,24);;/q;+1;-1/t17-;;/m1../s1
InChIKeyQUQBDPKRWYTMNC-ZEECNFPPSA-N
XLogP1.71
TPSA86.63 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds18
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.61
LogP ≤ 51.71
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

sodium;(2S)-2-(hexadecylamino)pentanedioic acid;hydride
CID 174767967
(2S)-2-(hexylamino)pentanedioic acid
CID 54122466
2-(octadecylamino)pentanedioic acid
CID 18765951
N-hexyl-N-pentylhexan-1-amine;2-(octadecylamino)pentanedioic acid
CID 175330066
(2S)-2-[[(Z)-icos-11-enyl]amino]pentanedioic acid
CID 151267787
(2S)-2-(6-carboxyhexylamino)decanoic acid
CID 124673847
2-(dodecylamino)hexanoic acid
CID 139637216
2-(pentylamino)octanoic acid
CID 129188286
(2S)-2-(15-carboxypentadecylamino)pentanedioic acid
CID 90970159
(2S)-5-amino-2-(octadecylamino)-5-oxopentanoic acid
CID 54197228
(2S)-5-amino-2-(dodecylamino)-5-oxopentanoic acid;hydrochloride
CID 174954933
2-(decylamino)butanedioic acid
CID 11162902

Frequently Asked Questions

What is the IUPAC name of potassium;hydride;(2R)-2-(tetradecylamino)pentanedioic acid?
The IUPAC name of potassium;hydride;(2R)-2-(tetradecylamino)pentanedioic acid (CID 174683925) is potassium;hydride;(2R)-2-(tetradecylamino)pentanedioic acid.
What is the SMILES notation for potassium;hydride;(2R)-2-(tetradecylamino)pentanedioic acid?
The canonical SMILES for potassium;hydride;(2R)-2-(tetradecylamino)pentanedioic acid is CCCCCCCCCCCCCCN[C@H](CCC(=O)O)C(=O)O.[H-].[K+].
What is the InChIKey of potassium;hydride;(2R)-2-(tetradecylamino)pentanedioic acid?
The InChIKey is QUQBDPKRWYTMNC-ZEECNFPPSA-N. The full InChI is InChI=1S/C19H37NO4.K.H/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-20-17(19(23)24)14-15-18(21)22;;/h17,20H,2-16H2,1H3,(H,21,22)(H,23,24);;/q;+1;-1/t17-;;/m1../s1.
What are the key properties of potassium;hydride;(2R)-2-(tetradecylamino)pentanedioic acid?
potassium;hydride;(2R)-2-(tetradecylamino)pentanedioic acid has a molecular weight of 383.61 g/mol, XLogP of 1.71, 18 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;hydride;(2R)-2-(tetradecylamino)pentanedioic acid is sourced from PubChem (CID 174683925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).